Molecule Details

COc1ccc(N2CCN(C(=O)CCl)CC2)cc1
piperazine-chloroacetamide Enamine Mcule MolPort
View on Fragalysis x1425
Molecular Properties
SMILES:
COc1ccc(N2CCN(C(=O)CCl)CC2)cc1
MW: 268.744
Fraction sp3: 0.46
HBA: 3
HBD: 0
Rotatable Bonds: 3
TPSA: 32.78
cLogP: 1.5826
Covalent Warhead: ✔️
Covalent Fragment:
Source
Enamine BB: EN300-34209
Enamine SCR: Z3868911917
Mcule: MCULE-7685898673
MolPort: MolPort-005-310-625

p-Alkoxy-N,N-dialkyl anilines

anil_di_alk_C(246)

O=C(CCl)N1CCN(C(=O)c2ccc(COc3ccc(N4CCN(C(=O)CCl)CC4)cc3)cc2)CC1

YOI-UNK-090ea88a-1
0.522

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COc1ccc([C@@H](C#N)N2CCN(C(=O)CCl)CC2)cc1

MAR-TRE-6a44bbf2-77
0.508

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COc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-7c9d1431-17
0.508

View
O=C(CCl)N1CCN(c2cccc(Cl)c2)CC1

SAD-SAT-65574d3f-9
0.500

View
Cc1cccc(N2CCN(C(=O)CCl)CC2)c1

SAD-SAT-5b1897b2-4
0.491

View
COc1ccc(-n2cc(CN3CCN(C(=O)CCl)CC3)nn2)cc1

ANT-STE-dbb91f63-1
0.485

View
COc1ccc(N(CC2CC2)c2cc(F)c(N3CCN(C(=O)CCl)CC3)c(F)c2)cc1

NIM-UNI-310206f0-48
0.447

View
COc1ccc(N(c2cc(F)c(N3CCN(C(=O)CCl)CC3)c(F)c2)c2ncccn2)cc1

NIM-UNI-310206f0-11
0.447

View
COc1ccc(C(c2cc(Cl)cc(Cl)c2)N2CCN(C(=O)CCl)CC2)cc1

GIA-UNK-4de5abb1-5
0.441

View
O=C(CCl)N1CCN(c2ccccn2)CC1

SAD-SAT-5b1897b2-3
0.424

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

SAD-SAT-1b030f84-9
0.419

View
COc1ccc(N2CCN(C(=O)CCS(=O)(=O)c3ccc4c(c3)NC(=O)C(C)S4)CC2)cc1

MAR-LAB-ff9967db-16
0.419

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COc1ccc(-c2ccc(S(=O)(=O)N3CCN(C(=O)CCl)CC3)s2)cc1

NIM-UNI-05f93fcc-15
0.417

View
NC(=O)N1CCN(C(=O)CCl)CC1

MAK-UNK-704ed37c-11
0.417

View
COc1ccc(OC)c(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1

MAK-UNK-7c9d1431-30
0.412

View
COc1ccc(OC)c(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1

MAR-TRE-6a44bbf2-45
0.412

View
CN(C)c1cc(F)c(N2CCN(C(=O)CCl)CC2)c(F)c1

NIM-UNI-310206f0-6
0.410

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O=C(CCl)N1CCN(c2c(F)cc(N3CCOCC3)cc2F)CC1

NIM-UNI-310206f0-7
0.409

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COc1ccc(N2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)CC2)cc1

BEN-DND-7e92b6ca-11
0.408

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COc1ccc(N2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)CC2)cc1

KRI-MAR-d2e3ef86-13
0.408

View
O=C(CCl)N1CCN(c2ccccc2F)CC1

SAD-SAT-5b1897b2-10
0.407

View
COc1ccc(N2CC3CC2CN3C(=O)CCl)cc1

MAK-UNK-3f402c2b-27
0.406

View
O=C(CCl)N1CCN(c2ncccn2)CC1

MAR-TRE-6a44bbf2-87
0.404

View
O=C(CCl)N1CCN(c2ncccn2)CC1

VIK-SYN-9a3d118a-4
0.404

View
O=C(CCl)N1CCN(c2ncccn2)CC1

VIK-SYN-bf9c9ac8-7
0.404

View
O=C(CCl)N1CCN(c2cnccn2)CC1

SAD-SAT-5b1897b2-1
0.400

View
Cc1cc(N2CCN(C(=O)CCl)CC2)nc(C(C)C)n1

MAR-TRE-6a44bbf2-41
0.400

View
COc1ccc(N2CCN(C(=O)CN(C)S(=O)(=O)c3ccc4c(c3)NC(=O)C(C)S4)CC2)cc1

MAR-LAB-ff9967db-32
0.400

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

AAR-POS-0daf6b7e-21
0.396

View
CCOc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-7c9d1431-22
0.394

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CC(C)c1coc(N2CCN(C(=O)CCl)CC2)n1

VIK-SYN-9a3d118a-2
0.391

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CC(C)c1coc(N2CCN(C(=O)CCl)CC2)n1

VIK-SYN-bf9c9ac8-6
0.391

View
CNC(=O)N1CCN(C(=O)CCl)CC1

MAK-UNK-704ed37c-12
0.385

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COc1cc(CN2CCN(C(=O)CCl)CC2)c2ccccc2c1

DAR-DIA-fb20be43-7
0.384

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COc1ccc(CN2CCN(C(=O)CCl)CC2)cc1F

SAD-SAT-5b1897b2-5
0.373

View
COc1ccc(N(c2cc(F)c(N3CCN(C(=O)CCl)CC3)c(F)c2)c2cccc3[nH]ccc23)cc1

NIM-UNI-310206f0-33
0.370

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O=C(CCl)N1CCN(c2ccccc2[N+](=O)[O-])CC1

AAR-POS-d2a4d1df-28
0.369

View
COc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1OC

MAK-UNK-7c9d1431-19
0.368

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

AAR-POS-d2a4d1df-25
0.367

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

AHN-SAT-de2502ba-8
0.367

View
CC(=O)C(=O)N1CCN(C(=O)CCl)CC1

MAK-UNK-987948f6-5
0.365

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O=C(CCl)N1CCN(Oc2ccsc2)CC1

MAK-UNK-212f693e-9
0.365

View
Cc1ccc(CN2CCN(C(=O)CCl)CC2)o1

MAR-LAB-ca4662a6-2
0.365

View
CC(C)N(C)C(=O)N1CCN(C(=O)CCl)CC1

YOI-UNK-15f562e8-4
0.364

View
CC(C)N(C)C(=O)N1CCN(C(=O)CCl)CC1

VIK-SYN-bf9c9ac8-1
0.364

View
CCNC(=O)N1CCN(C(=O)CCl)CC1

VIK-SYN-bf9c9ac8-2
0.364

View
Cc1ccc(OCC(=O)N2CCN(c3ccc(CN4CCC(O)CC4)cc3)CC2)cc1

MAK-UNK-acefcb18-20
0.362

View
COc1cccc(C(c2cc(Cl)cc(Cl)c2)N2CCN(C(=O)CCl)CC2)c1

GIA-UNK-4de5abb1-2
0.360

View
N#C[C@H](c1ccccc1)N1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-92
0.359

View
O=C(CCl)N1CCN(Cc2ccc(CS(=O)(=O)F)cc2)CC1

JIA-UNI-93b03cae-1
0.359

View
O=C(CCl)N1CCN(c2ncc(Cl)cc2Cl)CC1

SAD-SAT-5b1897b2-8
0.359

View
Cc1ccccc1C(=O)C(=O)N1CCN(C(=O)CCl)CC1

MAK-UNK-6ca90168-4
0.359

View
COc1cccc(-n2cc(CN3CCN(C(=O)CCl)CC3)nn2)c1

ANT-STE-dbb91f63-2
0.359

View
Cc1nc(C#N)c(N2CCN(C(=O)CCl)CC2)o1

MAR-TRE-6a44bbf2-29
0.358

View
O=C(CCl)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1

AHN-SAT-de2502ba-3
0.358

View
CC(C)NC(=O)N1CCN(C(=O)CCl)CC1

VIK-SYN-9a3d118a-1
0.357

View
O=C(CCl)N1CCN(Cc2ccccc2)CC1

MAK-UNK-7c9d1431-24
0.356

View
O=C(CCl)N1CCN(C(=O)c2ccccc2)CC1

MAK-UNK-987948f6-2
0.356

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

AHN-SAT-de2502ba-7
0.355

View
Cc1ccccc1CC(=O)N1CCN(C(=O)CCl)CC1

MAK-UNK-6ca90168-10
0.355

View
COc1cc(C)c(CN2CCN(C(=O)CCl)CC2)cc1OC

SAD-SAT-65574d3f-10
0.353

View
O=C(CCl)N1CCN(c2c(F)cc(-c3cn[nH]c3)cc2F)CC1

NIM-UNI-310206f0-4
0.352

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

MAK-UNK-987948f6-4
0.352

View
O=C(CCl)N1CCN(Cc2ccc(Cl)cc2)CC1

MAK-UNK-7c9d1431-29
0.350

View
Cc1ccc(C(=O)N2CCN(C(=O)CCl)CC2)cc1C

ASH-SAT-43770c7d-10
0.349

View
O=C(CCl)N1CCN(c2c(F)cc(OCC3CCOCC3)cc2F)CC1

NIM-UNI-310206f0-9
0.347

View
CCNc1ncc(OC)cc1CN1CCN(C(=O)CCl)CC1

DAR-DIA-fb20be43-5
0.347

View
COCC(=O)N(CC1CC1)c1cc(F)c(N2CCN(C(=O)CCl)CC2)c(F)c1

NIM-UNI-310206f0-37
0.346

View
COc1cnc(CNC(=O)N2CCOCC2)c(CN2CCN(C(=O)CCl)CC2)c1

DAR-DIA-fb20be43-18
0.345

View
O=C(CCl)N1CCN(C(c2ccccc2)c2ccccc2)CC1

SIM-SYN-f15aaa3a-1
0.344

View
O=C(CCl)N1CCN(C(=O)c2ccsc2)CC1

MAK-UNK-6ca90168-20
0.344

View
O=C(CCl)N1CCN(C(=O)c2ccoc2)CC1

SAD-SAT-3a925b8b-5
0.344

View
O=C(CCl)N1CCN(C(=O)c2ccco2)CC1

MAR-TRE-6a44bbf2-61
0.344

View
O=C(CCl)N1CCN(C(=O)c2ccco2)CC1

AAR-POS-d2a4d1df-29
0.344

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

MAR-TRE-6a44bbf2-52
0.344

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

MAR-TRE-6a44bbf2-68
0.344

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

MAR-LAB-efb042c5-5
0.344

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

AAR-POS-d2a4d1df-22
0.344

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

LON-WEI-8f408cad-3
0.344

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

AAR-POS-d2a4d1df-27
0.344

View
CC(CCc1ccccc1)N1CCN(C(=O)CCl)CC1

MAK-UNK-af83ef51-2
0.343

View
O=C(CCl)N1CCN(c2c(F)cc(-c3ccncc3)cc2F)CC1

NIM-UNI-310206f0-1
0.343

View
COCCc1ccc(Cl)cc1CN1CCN(C(=O)CCl)CC1

MED-COV-4280ac29-37
0.342

View
O=C(CCl)N1CCN(c2c(F)cc(N(c3cncnc3)c3ncccn3)cc2F)CC1

NIM-UNI-310206f0-20
0.342

View
COCCS(=O)(=O)N(CC1CC1)c1cc(F)c(N2CCN(C(=O)CCl)CC2)c(F)c1

NIM-UNI-310206f0-45
0.341

View
C=CC(=O)N1CCN(C(=O)CCl)CC1

MAK-UNK-6ca90168-16
0.340

View
O=C(CCl)N1CCN(C(=O)c2ccc(Br)s2)CC1

JOH-UNI-27ac80fd-25
0.339

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

AAR-POS-0daf6b7e-16
0.339

View
O=C(CCl)N1CCN(C(=O)C2=CC[SH]=C2)CC1

SAD-SAT-3a925b8b-1
0.339

View
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAR-TRE-6a44bbf2-78
0.338

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

AAR-POS-d2a4d1df-24
0.338

View
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-7c9d1431-13
0.338

View
Cc1ccccc1CN1CCN(C(=O)CCl)CC1

MAK-UNK-7c9d1431-20
0.338

View
O=C(CCl)N1CCN(C(=O)Nc2ccccc2O)CC1

SWA-SYN-6423ea73-1
0.338

View
O=C(CCl)N1CCN(C(=O)Nc2ccccc2O)CC1

SWA-SYN-d2e6fa14-1
0.338

View
CC(C#N)C(C(=O)N1CCN(C(=O)CCl)CC1)S(N)(=O)=O

SAD-SAT-89668ff1-8
0.338

View
CC(=O)Oc1ccc(C2CCN(C(=O)CCl)CO2)cc1

NIM-UNI-43fe0159-9
0.338

View
N#Cc1ccc(CNC(=O)N2CCN(C(=O)CCl)CC2)cc1

SWA-SYN-6423ea73-7
0.338

View
N#Cc1ccc(CNC(=O)N2CCN(C(=O)CCl)CC2)cc1

SWA-SYN-d2e6fa14-7
0.338

View
O=C(CCl)N1CCN(C(=O)c2cccc3ccccc23)CC1

MAK-UNK-6ca90168-1
0.338

View
COC1=CC=C(N2CCCN(C(=O)CCl)CC2)C=C1

0.784

View
COC1=CC=C(N2CCN(C(=O)CSC)CC2)C=C1

0.700

View
COC1=CC=C(N2CCN(C(=O)CS(C)(=O)=O)CC2)C=C1

0.660

View
CCS(=O)(=O)CC(=O)N1CCN(C2=CC=C(OC)C=C2)CC1

0.660

View
COC1=CC=C(N2CCN(C(=O)COC(C)=O)CC2)C=C1

0.648

View
CCSCC(=O)N1CCN(C2=CC=C(OC)C=C2)CC1

0.648

View
COC1=CC=C(N2CCN(C(=O)CSC(C)C)CC2)C=C1

0.648

View
COC1=CC=C(N2CCN(C(=O)CS(=O)(=O)C3=CC=C(OC)C=C3)CC2)C=C1

0.643

View
COC1=CC=C(OCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.636

View
CCN(CC)CC(=O)N1CCN(C2=CC=C(OC)C=C2)CC1

0.636

View
COC1=CC=C(N2CCN(C(=O)CN(C)OC)CC2)C=C1

0.636

View
CCS(=O)CC(=O)N1CCN(C2=CC=C(OC)C=C2)CC1

0.636

View
COC1=CC=C(N2CCN(C(=O)CN3C4CCC3CC4)CC2)C=C1

0.636

View
COC1=CC=C(N2CCN(C(=O)CN3C(=O)CCC3=O)CC2)C=C1

0.632

View
COC1=CC=C(N2CCN(C(=O)CN3CCCC3)CC2)C=C1

0.625

View
COC1=CC=C(N2CCN(C(=O)CSCC(C)=O)CC2)C=C1

0.625

View
CCC(=O)OCC(=O)N1CCN(C2=CC=C(OC)C=C2)CC1

0.625

View
COC1=CC=C(SCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.614

View
COC1=CC=C(NCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.614

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(Cl)C=C3)CC2)C=C1

0.610

View
COC1=CC=C(N2CCN(C(=O)CN3CCSSCC3)CC2)C=C1

0.610

View
COC1=CC=C(N2CCN(C(=O)CN3CCNCC3)CC2)C=C1

0.610

View
CCC(=O)N1CCCN(C2=CC=C(OC)C=C2)CC1

0.607

View
COC1=CC=C(N2CCCN(C(=O)CO)CC2)C=C1

0.607

View
COC1=CC=C(N2CCN(C(=O)CN3CCCCCC3)CC2)C=C1

0.603

View
COC1=CC=C(N2CCN(C(=O)CN3CCN(CC(=O)N4CCCC4)CC3)CC2)C=C1

0.603

View
COC1=CC=C(N2CCN(C(=O)CONC(C)=O)CC2)C=C1

0.603

View
COCC(=O)OCC(=O)N1CCN(C2=CC=C(OC)C=C2)CC1

0.603

View
CCN1CCN(CC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)CC1

0.603

View
COC1=CC=C(N2CCN(C(=O)CN3CCN(C(C)=O)CC3)CC2)C=C1

0.603

View
CCCN(CCC)CC(=O)N1CCN(C2=CC=C(OC)C=C2)CC1

0.603

View
COC1=CC=CC(N2CCN(C(=O)CCl)CC2)=C1

0.600

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(Br)C=C3)CC2)C=C1

0.600

View
COC1=CC=C(N2CCCN(C(=O)CN)CC2)C=C1

0.596

View
CCOC1=CC=C(OCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.593

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=CC=C3)CC2)C=C1

0.593

View
COC1=CC=C(N2CCN(C(=O)COC3=CC(OC)=CC(OC)=C3)CC2)C=C1

0.593

View
COC1=CC=C(N2CCN(C(=O)CN3CCCCCCC3)CC2)C=C1

0.593

View
COC1=CC=C(N2CCN(C(=O)CN3CCN(C)CC3)CC2)C=C1

0.593

View
COC1=CC=C(N(C)CC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.593

View
COC1=CC=C(N2CCN(C(=O)CN(C)CC(=O)N3CCCC3)CC2)C=C1

0.593

View
COCC(=O)N1CCCN(C2=CC=C(OC)C=C2)CC1

0.586

View
CCC(=O)N1CCN(C(=O)C=CC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)CC1

0.586

View
COC1=CC=C(N2CCCN(C(=O)CSC)CC2)C=C1

0.586

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(N4CCCC4)C=C3)CC2)C=C1

0.583

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(C)C=C3)CC2)C=C1

0.583

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(I)C=C3)CC2)C=C1

0.583

View
COC1=CC=C(N2CCN(C(=O)CN3CCN(C(=O)CN4CCCC4)CC3)CC2)C=C1

0.583

View
COC1=CC=C(N2CCN(C(=O)CN3CC(C)(C)C3(C)C)CC2)C=C1

0.583

View
COC1=CC=C(C(=O)OCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.583

View
COC1=CC=C(N2CCN(C(=O)CN3CCN(CC(=O)N4CCCCCC4)CC3)CC2)C=C1

0.583

View
COC1=CC=C(N2CCN(C(=O)CN3CCN(CC(=O)N4CCCCC4)CC3)CC2)C=C1

0.583

View
COC1=CC=C(N2CCCN(CC(=O)N3CCN(C4=CC=C(OC)C=C4)CC3)CC2)C=C1

0.583

View
CCC(=O)N1CCN(CC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)CC1

0.583

View
CCCOC1=CC=C(OCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.581

View
COCCOC1=CC=C(OCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.581

View
CCCC(=O)N1CCCN(C2=CC=C(OC)C=C2)CC1

0.576

View
COC1=CC=C(N2CCCN(C(=O)CC(C)(C)C)CC2)C=C1

0.576

View
COC1=CC=C(N2CCCN(C(=O)CCC(C)=O)CC2)C=C1

0.576

View
COC1=CC=C(N2CCCN(C(=O)CCO)CC2)C=C1

0.576

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(F)C=C3)CC2)C=C1

0.574

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(OCC(N)=O)C=C3)CC2)C=C1

0.574

View
COC1=CC=C(N2CCN(C(=O)CN3CCN(C4=CC=C(C)C=C4)CC3)CC2)C=C1

0.574

View
COC1=CC=C(N2CCN(C(=O)CN3CCC(C)(C)CC3)CC2)C=C1

0.574

View
COC1=CC=C(N2CCN(C(=O)CN3CCC4(CC3)CC4)CC2)C=C1

0.574

View
COC1=CC=C(N2CCN(C(=O)COC3=C(Cl)C=CC=C3Cl)CC2)C=C1

0.571

View
COC1=CC=C(N2CCCN(C(=O)CN(C)C)CC2)C=C1

0.567

View
COC1=CC=C(N2CCCN(C(=O)CCN)CC2)C=C1

0.567

View
CCC1=CC=C(OCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.565

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(C(C)=O)C=C3)CC2)C=C1

0.565

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(C(C)C)C=C3)CC2)C=C1

0.565

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=NC=C3)CC2)C=C1

0.565

View
CCOC1=CC=C(N2CCN(CC(=O)N3CCN(C4=CC=C(OC)C=C4)CC3)CC2)C=C1

0.565

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(C=O)C=C3)CC2)C=C1

0.565

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(Cl)C(Cl)=C3)CC2)C=C1

0.562

View
CCOC1=CC=C(N2CCN(C(=O)COC3=CC=C(OC)C=C3)CC2)C=C1

0.557

View
COCCC(=O)N1CCCN(C2=CC=C(OC)C=C2)CC1

0.557

View
COC1=CC=C(OCC(=O)OCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.556

View
COC1=CC=C(N2CCN(C(=O)COC3=CC=C(OC(C)C)C=C3)CC2)C=C1

0.556

View
COC1=CC=C(N(C#N)CC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.556

View
CCOC1=CC=C(N2CCN(C(=O)CC3=CC=C(OC)C=C3)CC2)C=C1

0.548

View
COC1=CC=C(N2CCCN(C(=O)CCC(N)=O)CC2)C=C1

0.548

View
COC1=CC=C(CC(=O)N2CCCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.548

View
COC(=O)C1=CC=C(OCC(=O)N2CCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.547

View
COC1=CC=C(C(=O)N2CCN(C(=O)CCl)CC2)C=C1

0.545

View
COC1=CC=C(CC(=O)N2CCN(C3=CC=C(C)C=C3)CC2)C=C1

0.541

View
CCC1=CC=C(N2CCN(C(=O)CC3=CC=C(OC)C=C3)CC2)C=C1

0.541

View
COC1=CC=C(OCC(=O)N2CCCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.540

View
CCOC1=CC=C(N2CCN(C(=O)CCOC3=CC=C(OC)C=C3)CC2)C=C1

0.540

View
COC1=CC=C(N2CCN(C(=O)COC(=O)COC3=CC=C(Cl)C=C3)CC2)C=C1

0.537

View
COC1=CC=C(NC(=O)N2CCN(C(=O)CCl)CC2)C=C1

0.534

View
COC1=CC=C(OCC(=O)N2CCN(C3=CC=C(C)C=C3)CC2)C=C1

0.532

View
COC1=CC=C(OCC(=O)N2CCN(C3=CC=C(O)C=C3)CC2)C=C1

0.532

View
COC1=CC=C(CCC(=O)N2CCN(C(=O)CCl)CC2)C=C1

0.526

View
COC1=CC=C(OCCC(=O)N2CCN(C3=CC=C(O)C=C3)CC2)C=C1

0.524

View
COC1=CC=C(OCCC(=O)N2CCCN(C3=CC=C(OC)C=C3)CC2)C=C1

0.523

View
COC1=CC=C(N2CCCN(C(=O)COC3=CC=C(Cl)C=C3)CC2)C=C1

0.522

View
COC1=CC=C(OCCC(=O)N2CCN(C3=CC=C(C)C=C3)CC2)C=C1

0.516

View
CCC1=CC=C(N2CCN(C(=O)COC3=CC=C(OC)C=C3)CC2)C=C1

0.516

View
COC1=CC=C(CCC(=O)N2CCCN(C(=O)CCl)CC2)C=C1

0.460

View
COc1ccccc1N1CCN(C(=O)CCl)CC1

0.190

View
COc1ccc(N2CCN(C(=O)CN(CC(N)=O)C(C)C)CC2)cc1

0.200

View
COc1cccc(N2CCN(C(=O)CCl)CC2)c1

0.197

View
COc1ccc(N2CCN(C(=O)CCN3CCN(c4ccccc4)CC3)CC2)cc1

0.197

View
COc1cccc(N2CCN(C(=O)CCl)CC2)c1.Cl

0.197

View
COc1ccc(N2CCN(CCNC(=O)C(C)(C)C)CC2)cc1

0.195

View
CCCC(=O)N1CCN(c2ccc(OC)cc2)CC1

0.194

View
CC#CC(=O)N1CCN(c2ccc(OC)cc2)CC1

0.194

View
COc1ccc(N2CCN(C(=O)C(C)C)CC2)cc1

0.187

View
COc1ccc(N2CCN(C(=O)C(C)(C)C)CC2)cc1

0.187

View
CCNC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1

0.175

View
CCN(CC)C(=O)C(=O)N1CCN(c2ccc(OC)cc2)CC1

0.174

View
COc1ccc(N2CCN(C(=O)CCCl)CC2)cc1

0.169

View
CC(=O)N1CCN(c2ccc(O)cc2)CC1

0.164

View
C=CC(=O)N(C)CCN(C)c1ccc(OC)cc1

0.162

View
C=CC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1

0.161

View
COc1ccc(N2CCN(CC(=O)N3CCN(c4ccccc4)CC3)CC2)cc1

0.160

View
CCC(=O)N1CCN(c2ccc(OC)cc2)CC1

0.153

View
COc1ccc(N2CCN(C(=O)CNC(C)=O)CC2)cc1

0.145

View
C=CC(=O)N1CCN(c2ccc(OC)cc2)CC1

0.145

View
COc1ccc(N2CCN(C(=O)CN(C)c3ccccc3)CC2)cc1

0.138

View
COc1ccc(N2CCN(C(=O)CN)CC2)cc1

0.115

View
COc1ccc(N2CCN(C(=O)CN)CC2)cc1.Cl

0.106

View
COc1ccc(N2CCN(C(C)=O)CC2)cc1

0.091

View
Cl.O=C(CCl)N1CCN(c2ccc(O)cc2)CC1

0.073

View
C(N1CCN(C2=CC=C(OC)C=C2)CC1)(=O)CC

0.729

View
C(N1CCN(C2=CC=C(OC)C=C2)CC1)(=O)CN(C)C

0.673

View
C(N1CCN(C2=CC=C(OC)C=C2)CC1)(=O)C

0.660

View
C(NCC(N1CCN(C2=CC=C(OC)C=C2)CC1)=O)(=O)C

0.636

View
N(CC(N1CCN(C2=CC=C(OC)C=C2)CC1)=O)(C)CC

0.636

View
C(NCC(N1CCN(C2=CC=C(OC)C=C2)CC1)=O)(=O)C(Cl)Cl

0.621

View
C(N1CCN(C2=CC=C(OC)C=C2)CC1)(C(Cl)Cl)=O

0.615

View
C(NCCN1CCN(C2=CC=C(OC)C=C2)CC1)(=O)C

0.508

View
C(NCCN1CCN(C2=CC=C(OC)C=C2)CC1)(C(Cl)Cl)=O

0.500

View
C1(OCC)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.473

View
C1(OCCC)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.466

View
C1(OCOC)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.466

View
C(N1CCN(C2=CC=C(OCC)C=C2)CC1)(=O)C(Cl)Cl

0.450

View
C1(OCCO)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.441

View
C1(OCSC)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.441

View
C1(OCC=O)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.433

View
C1(OCCF)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.433

View
C1(OCC=C)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.433

View
C1(OCC#N)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.426

View
C1(OCCN(C)C)=CC=C(N2CCN(C(C)=O)CC2)C=C1

0.413

View

Discussion: