Molecule Details

C#CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

Molecular Properties
SMILES:
C#CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1
MW: 256.305
Fraction sp3: 0.33
HBA: 2
HBD: 1
Rotatable Bonds: 2
TPSA: 49.41
cLogP: 1.4969
Covalent Warhead:
Covalent Fragment: ✔️

activated_acetylene

triple bond

Filter43_michael_acceptor_sp1

alkynyl michael acceptor2

triple_bond

O=C(CCl)N1CCN(S(=O)(=O)c2cccs2)CC1

LON-WEI-8f408cad-3

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O=C(CCl)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1

LON-WEI-8f408cad-4

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Cc1cccc(CN2CCN(C(=O)CCl)CC2)c1

AAR-POS-d2a4d1df-24

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Cc1ccc(C(=O)N2CCN(C(=O)CCl)CC2)cc1

AAR-POS-d2a4d1df-25

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O=C(CCl)NNC(=O)c1cc2c(s1)CCCC2

AAR-POS-d2a4d1df-26

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Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

AAR-POS-d2a4d1df-27

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O=C(Nc1ccccc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-15
0.625

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O=C(Nc1ccccc1)C1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-86
0.625

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C=CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

JAG-SYN-9c2cd0bd-3
0.625

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O=C(Nc1ccccc1)C1CCN(C(=O)CB(O)O)CC1

JAG-SYN-9c2cd0bd-8
0.603

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O=C(Nc1ccccc1)C1CCN(C(=O)C2CO2)CC1

JAG-SYN-9c2cd0bd-7
0.603

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O=C(Nc1ccccc1)C1CCN(CCCl)CC1

JAG-SYN-9c2cd0bd-9
0.579

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O=C(Nc1ccccc1)C1CCN(CB(O)O)CC1

JAG-SYN-9c2cd0bd-14
0.552

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NC(=O)/C=C/CN1CCC(C(=O)Nc2ccccc2)CC1

BEN-DND-031a96cc-4
0.516

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CC(=O)/C=C/CN1CCC(C(=O)Nc2ccccc2)CC1

BEN-DND-031a96cc-5
0.516

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O=C(Nc1ccccc1)C1CCN(C(=O)C2OC2c2cccnc2)CC1

BEN-DND-031a96cc-3
0.493

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O=C(Nc1ccccc1)C1CCN(C(=O)C(Cl)c2cccnc2)CC1

BEN-DND-031a96cc-2
0.486

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O=C(Nc1ccccc1)C1CCN(C(=O)C(Cl)Cc2cccnc2)CC1

BEN-DND-031a96cc-1
0.480

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O=C(Nc1ccc(Cl)cc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-20
0.438

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NC(=O)C1CCN(C(=O)Nc2ccccc2)CC1

AAR-POS-0daf6b7e-32
0.426

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O=C(Nc1ccccc1)C1CCc2sccc2C1

JAG-SYN-9c2cd0bd-5
0.412

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CC(=O)c1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cc1

LON-WEI-120e5cf5-10
0.403

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CC(=O)c1cccc(NC(=O)C2CCN(C(=O)CCl)CC2)c1

LON-WEI-120e5cf5-19
0.389

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O=C(Nc1cccnc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-11
0.386

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O=C(Nc1ccccc1O)C1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-15
0.362

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O=C(Nc1ccccc1O)C1CCN(C(=O)CCl)CC1

AAR-POS-0daf6b7e-6
0.362

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O=C(Nc1ccc(N2CCNC2=O)cc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-4
0.355

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O=C(Nc1ccccc1Br)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-16
0.352

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O=C(Nc1ccccc1)N1CCN(S(=O)(=O)F)CC1

SAD-SAT-2fd372d1-8
0.344

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O=C(Nc1cccnc1)C1CCN(S(=O)(=O)Cc2ccccc2Cl)CC1

MAR-TRE-3e4e6814-54
0.341

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CN1CCN(C(=O)Nc2ccccc2)CC1

AAR-POS-0daf6b7e-44
0.339

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C#CC(=O)N1CCC(Oc2ccsc2)CC1

MAK-UNK-212f693e-22
0.338

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O=C(Nc1ccn(-c2ccccc2)n1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-12
0.333

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COc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cn1

AAR-POS-5507155c-2
0.329

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COc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cn1

LON-WEI-120e5cf5-17
0.329

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O=C(Nc1ccccc1C1COC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-3d7e3904-3
0.329

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COc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cn1

AAR-POS-f650c5f2-4
0.329

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COc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)cn1

LON-WEI-120e5cf5-1
0.329

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O=C(Nc1ccccc1N1CCC1)C1CCN(C(=O)CCl)CC1

MAK-UNK-3d7e3904-2
0.329

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O=C(Nc1ccccc1)C1CC2CC1CN2C(=O)CCl

MAK-UNK-5d2caa6f-20
0.329

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O=C(CC(=O)N1CCOCC1)Nc1ccccc1

GIA-UNK-3f36037a-2
0.328

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O=C(Nc1cccc(-c2cc[nH]n2)c1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-2
0.325

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O=C(Nc1cc(Cl)nc2ccccc12)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-14
0.325

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COc1cc(NC(=O)C2CCN(C(=O)CCl)CC2)cc(OC)c1OC

LON-WEI-120e5cf5-3
0.324

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O=C(CN1CCNCC1)Nc1ccccc1

WIL-LEE-23e8b574-6
0.323

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O=C(Nc1cccnc1)C1CCN(S(=O)(=O)c2cccnc2)CC1

MAR-TRE-d0525fbf-90
0.320

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O=C(S)C1CCN(C(=O)Cc2ccccc2)CC1

GIA-UNK-5ec6c2b8-5
0.318

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O=C(CCl)N1CCN(C(=O)Nc2ccccc2)CC1

AHN-SAT-de2502ba-7
0.318

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O=C(Nc1ccc2c(c1)[nH]c1ccccc12)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-9
0.318

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O=C(c1ccccc1)N1CCC(Nc2ccccc2)C1

ZAC-WAB-0847d168-1
0.314

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O=C(Nc1cccnc1)C1CCN(S(=O)(=O)c2ccc(Oc3ccccc3)cc2)CC1

KEI-TRE-d5e2018a-38
0.314

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C/C(O)=C(/C#N)C(=O)Nc1ccccc1

JOH-SUS-bab12148-1
0.311

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O=C(Nc1cccc(C2=NN=C3CCCCC32)c1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-6
0.308

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CCc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)nc1

MAK-UNK-c97f7c8f-2
0.307

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O=C(Nc1nnc(-c2ccc(Br)s2)s1)C1CCN(C(=O)c2ccccc2)CC1

DRA-CSI-3ab97369-13
0.306

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O=C(Nc1nnc(-c2ccc(Br)s2)s1)C1CCN(C(=O)c2ccccc2)CC1

DRA-CSI-13f611db-1
0.306

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CC(Br)NC(=O)Nc1ccccc1

MAX-MCD-16e3709a-1
0.305

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O=C(Nc1ccccc1OC1CS(=O)(=O)C1)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-7
0.305

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O=C(CCl)Nc1ccccc1

SAD-SAT-6b5a89f0-8
0.304

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COc1ccc(-c2nc3ccc(NC(=O)C4CCN(C(=O)c5ccccc5)CC4)cc3o2)cc1

DRA-CSI-7ec17797-1
0.302

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O=C(Nc1ccccc1OC1CCN(Cc2ccccc2)CC1)C1CCN(C(=O)CCl)CC1

MED-COV-4280ac29-17
0.300

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Cc1cccnc1NC(=O)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-21
0.299

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O=C(Nc1ccccc1)c1ccccc1

CHR-SOS-7098f804-9
0.298

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Cc1ccc(NC(=O)C2CCN(C(=O)CCl)CC2)nc1

MAK-UNK-c97f7c8f-1
0.297

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O=C(Nc1ccccc1)N1CCc2sccc2C1

JAG-SYN-9c2cd0bd-6
0.297

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O=C(S)C1CCN(C(=O)c2ccccc2)CC1

GIA-UNK-5ec6c2b8-1
0.297

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CC1NCCN(c2cnc(C#N)c(C(=O)Nc3ccccc3)c2)C1C

JOH-UNI-522b0723-7
0.295

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NC(=O)C1CCN(C(=O)C(Cl)C(C(=O)Nc2ccccc2)c2cccnc2)CC1

BEN-DND-031a96cc-6
0.295

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O=C(Nc1ccccc1Oc1ccccn1)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-8
0.294

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Cc1nc(-c2ccccc2)c(NC(=O)C(=O)N2CCC(C(=O)Nc3ccccc3O)CC2)s1

JAR-IMP-ed466bb3-10
0.293

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N#CCSCC(=O)Nc1ccccc1

MAR-TRE-14ce9fd6-61
0.292

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O=C(Nc1ccccc1)c1ccc2[nH]ccc2c1

NAU-LAT-64f4b287-8
0.292

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O=C(Nc1ccccc1O)C1CCN(C(=O)CCC(=O)N2Cc3ccccc3C(c3ccccc3)C2)CC1

JAR-IMP-ed466bb3-12
0.292

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O=C(CC(=O)Nc1ccncc1)Nc1ccccc1

GIA-UNK-3f36037a-7
0.290

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O=C(Nc1ccccc1)NN(C(=O)CCl)c1ccccc1

TAT-ENA-80bfd3e5-23
0.290

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NC(=O)C1CCN(C/C=C(\C(=O)Nc2ccccc2)c2cccnc2)CC1

BEN-DND-031a96cc-7
0.287

View
O=C(Nc1ccccc1)N1CCC(N2Cc3ccccc3C(c3ccccc3)C2)CC1

JAR-IMP-ed466bb3-9
0.287

View
O=C(Nc1cccnc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1

KEI-TRE-d5e2018a-73
0.287

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C#CC(=O)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1

JAG-SYN-9c2cd0bd-2
0.286

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Cc1ccnc(NC(=O)C2CCN(C(=O)CCl)CC2)c1

LON-WEI-120e5cf5-13
0.286

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CN(C)c1nc(NC(=O)C2CCN(C(=O)c3ccccc3)CC2)nc2[nH]cnc12

DRA-CSI-7ec17797-3
0.286

View
O=C(CN1CCC(C(=O)Nc2ccc(Cl)nc2)CC1)Nc1ccc(F)cc1

MAR-TRE-7f7bb9f0-26
0.286

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Nc1cncc(NC(=O)Nc2ccccc2)c1

SID-ELM-2583a2cd-5
0.284

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Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)Nc2cccnc2)CC1

MAR-TRE-2fd8122f-19
0.282

View
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)Nc2cccnc2)CC1

MAR-TRE-2fd8122f-29
0.282

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O=C(Nc1c[nH]c2ccc(Br)cc12)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-18
0.282

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CC(=O)N[C@H](C(=O)NCC#CBr)[C@H](C)Oc1ccccc1NC(=O)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-6
0.280

View
O=C(Nc1ccccc1O)C1CCN(N2Cc3ccccc3C(c3ccccc3)C2)CC1

JAR-IMP-ed466bb3-17
0.278

View
CC(C)(CNC(=O)C1CCN(C(=O)CCl)CC1)c1coc(-c2ccccc2)n1

SAD-SAT-29425be4-4
0.278

View
CC(C)(C)OC(=O)C(C)(NC(=O)C1CCN(C(=O)CCl)CC1)c1ccccc1

SAD-SAT-29425be4-23
0.277

View
N#Cc1ncc(N2CCOCC2)cc1C(=O)Nc1ccccc1

JOH-UNI-522b0723-10
0.277

View
O=C(Nc1cccnc1)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1

MAR-TRE-04c86cea-46
0.277

View
O=C(OCc1ccccc1)c1ccc(CNC(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-29
0.276

View
CC1CN(c2cnc(C#N)c(C(=O)Nc3ccccc3)c2)CCN1C

JOH-UNI-522b0723-9
0.276

View
CC1C(Oc2ccccc2NC(=O)C2CCN(C(=O)CCl)CC2)CCCN1Cc1ccccc1

MAK-UNK-a7992eb3-5
0.276

View
CC(C)(C)C(=O)N1CCC(Cc2ccccc2)CC1

DRA-CSI-47e38074-12
0.275

View
O=C(Nc1ccccc1)C1CC2CC1CN2C(=O)C(Cl)Cc1cccnc1

MAK-UNK-10799360-24
0.275

View
O=C(Nc1ccccc1)c1ccccc1O

CLI-UNI-032f7715-2
0.274

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CC(=O)N1CCC(C(=O)N2CCC(Cc3ccccc3)CC2)CC1

AAR-POS-fca48359-5
0.274

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NS(=O)(=O)c1ccc2cccc(NC(=O)C3CCN(C(=O)CCl)CC3)c2c1

MAK-UNK-69bf97dd-4
0.273

View
COc1ccc(-c2nc3ccc(NC(=O)C4CCN(Cc5ccccc5)CC4)cc3o2)cc1

DRA-CSI-0a78d9ba-1
0.273

View
CC1COCCN1c1cnc(C#N)c(C(=O)Nc2ccccc2)c1

JOH-UNI-522b0723-12
0.273

View
O=C(Nc1ccccc1OCC1CN(Cc2ccccc2)CCO1)C1CCN(C(=O)CCl)CC1

MAK-UNK-a7992eb3-2
0.273

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CC1CN(c2cnc(C#N)c(C(=O)Nc3ccccc3)c2)CCN1

JOH-UNI-522b0723-8
0.273

View
NCCC(CCl)C(=O)c1ccc2c(c1)[nH]c1cc(NC(=O)C3CCN(C(=O)CCl)CC3)ccc12

ASH-SAT-43770c7d-7
0.271

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CC1CN(c2cnc(C#N)c(C(=O)Nc3ccccc3)c2)CCO1

JOH-UNI-522b0723-11
0.270

View
CC(C)C#CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.732

View
CC#CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.707

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.703

View
O=C(Nc1ccccc1)C1CCN(C(=O)C#Cc2ccccc2)CC1

0.690

View
O=C(Nc1ccccc1)C1CCN(C(=O)C#CC2CC2)CC1

0.690

View
C#CC1CCN(C(=O)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.690

View
C#CC(C)(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.674

View
NC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.667

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CC2)CC1

0.667

View
C#CCC(CC#C)NC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.667

View
CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.667

View
C#CCCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.659

View
CC(C)(C)C#CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.659

View
C#CCNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.659

View
O=C(Nc1ccccc1)C1CCN(C(=S)Nc2ccccc2)CC1

0.650

View
O=C(Nc1ccccc1)C1CCN(C(=O)c2ccccc2)CC1

0.650

View
O=C(Nc1ccc(NC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)cc1)C1CC1

0.650

View
O=C(Nc1ccccc1)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.650

View
O=C(Nc1ccccc1)C1CCN(C(=O)N2CCC2)CC1

0.650

View
O=C(Nc1ccccc1)C1CCN(C(=O)N2CCCC2)CC1

0.650

View
O=C(Nc1ccc(NC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1)C1CC1

0.650

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(=O)N2CCCC2)CC1

0.650

View
C#CCOC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.644

View
C#CCN1CCC(C(=O)Nc2ccccc2)CC1

0.643

View
O=C(Nc1ccccc1)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1

0.636

View
O=C(Nc1ccccc1)C1CCN(C(=O)[C@H]2C[C@@H]2c2ccccc2)CC1

0.636

View
CN(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.634

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCC2)CC1

0.634

View
NC(=O)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.634

View
O=C(Nc1ccccc1)C1CCN(C(=O)N2CCCCC2)CC1

0.634

View
O=C(Nc1ccccc1)C1CCN(C(=O)N2CCCCCC2)CC1

0.634

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCCC2)CC1

0.634

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(C2CC2)C2CC2)CC1

0.634

View
CNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.634

View
O=C(O)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.634

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(=O)N2CCCCCCC2)CC1

0.634

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(=O)N2CCCCCC2)CC1

0.634

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(=O)N2CCC(F)CC2)CC1

0.634

View
C#CCNC(=S)N1CCC(C(=O)Nc2ccccc2)CC1

0.630

View
C#CCCCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.630

View
C#CCN1CCC(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.630

View
C#Cc1cccc(NC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)c1

0.630

View
C#CCOCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.630

View
COCC#CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.630

View
C#CC(C)NC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.630

View
C#CCC(C)(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.630

View
C#Cc1cccc(NC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1

0.630

View
C#CCNCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.630

View
O=C(Nc1ccccc1)C1CCN(C(=O)C#CC2CCNCC2)CC1

0.630

View
O=C(Nc1ccccc1)C1CCC(C(=O)Nc2ccccc2)CC1

0.629

View
O=C(Nc1ccccc1)[C@H]1CC[C@H](C(=O)Nc2ccccc2)CC1

0.629

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(=O)N2CC=CCC2)CC1

0.628

View
CC(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CC=CC2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCCCCC2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCC(C3CC3)CC2)CC1

0.619

View
COC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCN(C(=O)Nc3ccccc3)CC2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCCCCCC2)CC1

0.619

View
CC(C)(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)CO)CC1

0.619

View
CCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.619

View
CC1CCN(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.619

View
CNC(=O)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)NC2CC2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(F)F)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCCCC2)CC1

0.619

View
O=C(Nc1ccc(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1)C1CC1

0.619

View
O=C(C(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCC(F)CC2)CC1

0.619

View
O=C(Nc1ccc(NC(=O)C2CC2)cc1)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.619

View
NCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(F)(F)F)CC1

0.619

View
CC1CCN(C(=O)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.619

View
CC(=O)C1CCN(C(=O)C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(=O)N2CCC(O)CC2)CC1

0.619

View
O=C(Nc1ccccc1)C1CCN(C(=O)C(=O)N2CCNCC2)CC1

0.619

View
C#CCCCCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.617

View
C#CCSCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.617

View
O=C(Nc1ccccc1)C1CCN(C(=O)C#Cc2cccs2)CC1

0.617

View
C#CCCOC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.617

View
C#CC(NC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1

0.617

View
CN1CCC(C(=O)Nc2ccccc2)CC1

0.615

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCC(c3ccccc3)CC2)CC1

0.614

View
N#CCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.614

View
O=C(NNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccccc1

0.614

View
O=C(Nc1ccccc1)C1CCN(C(=O)NC(C2CC2)C2CC2)CC1

0.614

View
C#CCCN1CCC(C(=O)Nc2ccccc2)CC1

0.614

View
O=C(Nc1ccccc1)C1CCN(C(=O)[C@H]2C[C@@H](C(=O)O)C2)CC1

0.614

View
CS(=O)(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.610

View
NS(=O)(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.610

View
Cc1nc(C)c(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c(C)n1

0.609

View
O=C(Nc1ccccc1)C1CCN(C(=O)CC2CC(c3ccccc3)C2)CC1

0.609

View
CNC(=S)N1CCC(C(=O)Nc2ccccc2)CC1

0.605

View
CC(=O)N1CCC(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)CC1

0.605

View
O=C(c1ccccc1)c1ccc(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1

0.605

View
O=C(Nc1ccccc1)C1CCN(C(=O)CC2CC2)CC1

0.605

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2Cc3ccccc3C2)CC1

0.605

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CC(F)C2)CC1

0.605

View
CC(C)=C(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.605

View
CN(C(=O)CCCNC(=O)C(C)(C)C)c1ccccc1

0.200

View
CCCCCNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.198

View
CCN(CC)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.198

View
CCN(C(=O)C1CCNC(=O)C1)c1ccc(NC(=O)C2CCNC(=O)C2)cc1

0.198

View
C=C(C)CN1CCC(C(=O)Nc2ccccc2)CC1

0.198

View
CC(=O)N1CCC(C(=O)Nc2ccc(Br)cc2)CC1

0.195

View
CC(=O)N1CCC(C(=O)Nc2ccccc2C)CC1

0.195

View
CCC(=O)N1CCC(C(=O)Nc2ccc(F)cc2)CC1

0.195

View
CC1CCN(CC2CCN(CC(=O)N3CCC(C(=O)Nc4ccccc4)CC3)CC2)CC1

0.195

View
CC(C)(C)C1CCC(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.195

View
O=C(Nc1ccc2ccccc2c1)C1CCN(C(=O)C2CC2)CC1

0.195

View
C#CCN1CCC(C(=O)Nc2ccccc2NCCC)CC1

0.195

View
CCNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.192

View
CC(=O)N1CCC(C(=O)Nc2cccc3ccccc23)CC1

0.189

View
CCc1ccc(NC(=O)C2CCN(C(C)=O)CC2)cc1

0.189

View
CC(C)(C)C(=O)N1CCC(C(=O)Nc2ccc(Cl)cc2)CC1

0.188

View
CC(C)C(=O)N1CCC(C(=O)Nc2ccc(Cl)cc2)CC1

0.188

View
CC(=O)N1CCC(C(=O)Nc2ccccc2Cl)CC1

0.187

View
C=CC(=O)N1CCC(C(=O)Nc2cccc(NC(=O)C(C)C)c2)CC1

0.187

View
CN(C(=O)C1CCNCC1)c1ccccc1.Cl

0.186

View
CN(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.186

View
CC(=O)N1CCC(C(=O)Nc2ccc(F)cc2)CC1

0.183

View
CC(=O)N1CCC(C(=O)Nc2ccc(I)cc2)CC1

0.183

View
Cc1cc(C)cc(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)c1

0.183

View
CCCC(=O)N1CCC(C(=O)Nc2cc(C)cc(C)c2)CC1

0.183

View
COCCCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.183

View
O=C(Nc1ccc(NCC2CCCC2)cc1)C1CCN(C(=O)C2CC2)CC1

0.183

View
C#CCN1CCC(C(=O)Nc2ccc(I)cc2)CC1

0.183

View
Cc1cccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)c1

0.183

View
Cc1ccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)cc1

0.183

View
CCCC(=O)N1CCC(C(=O)Nc2ccc(Cl)cc2)CC1

0.182

View
CC(C)(C)C(=O)Nc1cccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)c1

0.182

View
O=C(Nc1ccc(N2CCCCCC2)cc1)C1CCN(C(=O)C2CC2)CC1

0.182

View
CC=CC=CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.180

View
Cc1cccc(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)c1

0.177

View
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CCCCC2)CC1

0.177

View
CC1CCN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.177

View
Cc1ccc(NC(=O)C2CCN(C(=O)C(C)C)CC2)cc1

0.177

View
Cc1cccc(NC(=O)C2CCN(C(=O)C(C)C)CC2)c1

0.177

View
CC(C)(C)C(=O)N1CCC(C(=O)Nc2ccc(N3CCCCCC3)cc2)CC1

0.176

View
CC(=O)Nc1cccc(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)c1

0.176

View
CC(=O)N1CCC(C(=O)Nc2cc(C)cc(C)c2)CC1

0.171

View
CCC(=O)N1CCC(C(=O)Nc2ccc(C)cc2)CC1

0.171

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CCCC2)CC1

0.171

View
CC(C)CC(=O)Nc1ccc(NC(=O)C2CCN(C(=O)C3CCC3)CC2)cc1

0.171

View
C#CCN1CCN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)CC1

0.170

View
CC(=O)N1CCC(C(=O)Nc2ccc(Cl)cc2)CC1

0.169

View
CCN(c1ccc(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)cc1)C(C)C

0.169

View
CCC(=O)N1CCC(C(=O)Nc2cccc(NC(C)=O)c2)CC1

0.169

View
CC(C)CC(=O)N1CCC2(CC1)CN(c1ccccc1)C2=O

0.169

View
O=C(C1CC1)N1CCC2(CC1)CN(c1ccccc1)C2=O

0.169

View
[C]C([C])=[C]C(=O)N1[C][C][C](C(=O)[N]c2ccccc2)[C][C]1

0.168

View
C#CCN1CCC(C(=O)Nc2ccc(C)cc2)CC1

0.165

View
CC(=O)N1CCC(C(=O)Nc2cccc(C)c2)CC1

0.164

View
CC(C)C(=O)N1CCC2(CC1)CN(c1ccccc1)C2=O

0.163

View
CCC(=O)N1CCC2(CC1)CN(c1ccccc1)C2=O

0.163

View
C=CC(=O)N1CCC(C(=O)Nc2ccc(N(C)C(=O)C3CC3)cc2)CC1

0.162

View
CC(=O)N1CCC(C(=O)Nc2ccc(C)cc2)CC1

0.157

View
CC(=O)N1CCC(C(=O)Nc2ccc(Nc3ccccc3)cc2)CC1

0.157

View
COCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.157

View
CC(=O)Nc1cccc(NC(=O)C2CCN(C(C)=O)CC2)c1

0.156

View
CC(C)(C)C(=O)N1CCC(C(=O)Nc2ccc(N3CCCC3=O)cc2)CC1

0.156

View
C=CC(=O)N1CCC(C(=O)Nc2ccc(N(C)C(C)=O)cc2)CC1

0.155

View
CN1CCC(C(=O)Nc2ccccc2)CC1

0.148

View
CC(C)CC(=O)Nc1ccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)cc1

0.144

View
CC(=O)N1CCC(C(=O)Nc2ccc(N3CCCC3=O)cc2)CC1

0.143

View
O=C(Nc1ccccc1)C1CCN(C(=O)CCl)CC1

0.137

View
CC(C)CC(=O)Nc1ccc(NC(=O)C2CCN(C(=O)C(C)C)CC2)cc1

0.137

View
CC(C)(C)C(=O)Nc1ccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)cc1

0.130

View
CC(=O)N1CCC(C(=O)Nc2ccc(N3CCCCC3)cc2)CC1

0.129

View
CC(=O)Nc1ccc(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)cc1

0.123

View
CC(=O)N1CCC(C(=O)Nc2ccc(N(C)C)cc2)CC1

0.122

View
CCCCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.101

View
O=C(Nc1ccccc1)C1CCN(C(=O)C2CC2)CC1

0.101

View
CCN(C(=O)C1CCN(C(=O)C(C)(C)C)CC1)c1ccccc1

0.100

View
CC(C)C(=O)N1CCC(C(=O)N(C)c2ccccc2)CC1

0.100

View
CC(C)(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.093

View
CCC(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.093

View
CC(C)C(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.093

View
CC(C)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.093

View
CCCC(=O)N1CCC(C(=O)N(C)c2ccccc2)CC1

0.092

View
CCCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.085

View
CCN(C(=O)C1CCN(C(C)=O)CC1)c1ccccc1

0.085

View
C#CCN1CCC(C(=O)Nc2ccccc2)CC1

0.078

View
CC(=O)N1CCC(C(=O)N(C)c2ccccc2)CC1

0.077

View
CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1

0.070

View
C(NC1=CC=CC=C1)(=O)C1CCN(C(C)=O)CC1

0.942

View
C(NC1=CC=C(C)C=C1)(=O)C1CCN(C(C)=O)CC1

0.873

View
C(NC1=CC=C(F)C=C1)(=O)C1CCN(C(C)=O)CC1

0.868

View
C(NC1=CC=CC(I)=C1)(=O)C1CCN(C(C)=O)CC1

0.865

View
C(NC1=CC=C(I)C=C1)(=O)C1CCN(C(C)=O)CC1

0.860

View


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