Molecule Details

O=C(CCl)N1CCN(Cc2cccc3ccccc23)CC1
piperazine-chloroacetamide Enamine Mcule MolPort Assayed
View on Fragalysis x0830
Molecular Properties
SMILES:
O=C(CCl)N1CCN(Cc2cccc3ccccc23)CC1
MW: 302.805
Fraction sp3: 0.35
HBA: 2
HBD: 0
Rotatable Bonds: 3
TPSA: 23.55
cLogP: 2.7228
Covalent Warhead: ✔️
Covalent Fragment:
Source
Enamine BB: EN300-23054
Enamine SCR: Z147647860
Enamine Extended REAL: m_270062____7596080____8147258
Mcule: MCULE-1060390026
MolPort: MolPort-004-521-189
Activity Data
IC50 (µM) - Fluorescence: 5.76179265691728
IC50 (µM) - RapidFire: 0.900345343667903
Trypsin IC50 (µM): 99.0
pIC50 (µM) - Fluorescence 5.23944237423625
Average Inhibition @ 50 µM - Fluorescence: 98.5734
Average Inhibition @ 20 µM - RapidFire: 100.021070736765
Average Inhibition @ 50 µM - RapidFire: 100.423677336878
Relative Solubility @ 20 µM: 0.99
Relative Solubility @ 100 µM: 0.98
Order Status
Ordered: 2020-04-17
Synthesis Location: enamine
Shipped: 2020-05-07
O=C(CCl)N1CCN(Cc2cccc3ccccc23)CC1

MED-COV-4280ac29-31
1.000

View
C=CC(=O)N1CCN(Cc2cccc3ccccc23)CC1

JOO-IND-6372a4f3-4
0.672

View
O=C(C(F)Cl)N1CCN(Cc2cccc3ccccc23)CC1

JOO-IND-6372a4f3-6
0.667

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O=C(CCl)N1CCN(Cc2cc(F)cc3ccccc23)CC1

DAR-DIA-fb20be43-2
0.656

View
CC#CC(=O)N1CCN(Cc2cccc3ccccc23)CC1

JOO-IND-6372a4f3-5
0.631

View
O=C(CCl)N1CCN(Cc2cc(Cl)cc3ccccc23)CC1

PAU-UNI-19862c28-1
0.621

View
O=C(CCl)N1CCN(Cc2cc(Cl)cc3ccccc23)CC1

DAR-DIA-fb20be43-8
0.621

View
NS(=O)(=O)c1ccc2c(CN3CCN(C(=O)CCl)CC3)cccc2c1

DAR-DIA-fb20be43-9
0.614

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

DAR-DIA-fb20be43-7
0.594

View
N#Cc1cc(CN2CCN(C(=O)CCl)CC2)c2ccccc2c1

DAR-DIA-fb20be43-6
0.586

View
NS(=O)(=O)c1ccc2cccc(CN3CCN(C(=O)CCl)CC3)c2c1

MIH-UNI-e573136b-4
0.586

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Cc1ccccc1CN1CCN(C(=O)CCl)CC1

MAK-UNK-7c9d1431-20
0.524

View
O=C(CCl)N1CCN(Cc2scc3ccccc23)CC1

PAU-UNI-b2b6b158-1
0.522

View
O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(Cc2cccc3ccccc23)CC1

KRI-MAR-d2e3ef86-6
0.519

View
O=C(CCl)N1CCN(Cc2cccc3ccccc23)CC1c1cccnc1

MIH-UNI-e573136b-2
0.500

View
O=C(CCl)N1CCN(Cc2cccc3ccccc23)CC1Cc1cccnc1

MIH-UNI-e573136b-3
0.488

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O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cc3cccc4ccccc34)cc2)CC1

MED-COV-4280ac29-5
0.487

View
NS(=O)(=O)CCc1ccccc1CN1CCN(C(=O)CCl)CC1

MIH-UNI-e573136b-5
0.486

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O=C(CCl)N1CCN(Cc2ccccc2)CC1

MAK-UNK-7c9d1431-24
0.483

View
O=C(CCl)N1CC2CC1CN2Cc1cccc2ccccc12

MAK-UNK-3f402c2b-14
0.479

View
O=C(NCCN1CCN(C(=O)CCl)CC1)c1cccc2ccccc12

STE-KUL-2e0d2e88-2
0.473

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CCNc1ccccc1CN1CCN(C(=O)CCl)CC1

SEL-UNI-cd366922-6
0.471

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

MAK-UNK-6ca90168-1
0.471

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cc3cccc4ccccc34)s2)CC1

MAK-UNK-e05327b2-8
0.469

View
O=C(CCl)N1CCN(Cc2cscc2Cl)CC1

SAD-SAT-bc31ec01-1
0.469

View
CC(=O)NCCc1cn(C)c2c(CN3CCN(C(=O)CCl)CC3)cccc12

TAM-UNI-d1c3dd9f-20
0.463

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CNC(=O)Cc1c(C)cccc1CN1CCN(C(=O)CCl)CC1

STE-UNK-13e151dd-1
0.459

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

AAR-POS-d2a4d1df-24
0.455

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O=C(CCl)N1CCN(Cc2cc(O)ccc2O)CC1

NEH-REV-107bcf72-5
0.448

View
O=C(CCl)N1CCN(Cc2cccs2)CC1

LON-WEI-8f408cad-5
0.446

View
O=C(CCl)N1CCN(Cc2cccs2)CC1

AAR-POS-0daf6b7e-17
0.446

View
O=C(CCl)N1CCN(Cc2cccc(Cl)c2)CC1

MED-COV-4280ac29-15
0.439

View
O=C(CCl)N1CCN(Cc2cccc(Cl)c2)CC1

AAR-POS-d2a4d1df-35
0.439

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Cc1ccccc1CN1CCCN(C(=O)CCl)CC1

TAT-ENA-80bfd3e5-20
0.437

View
Cc1ccccc1CN1CCCN(C(=O)CCl)CC1

AAR-POS-d2a4d1df-41
0.437

View
CC(=O)Nc1ccc(C#N)cc1CN1CCN(C(=O)CCl)CC1

TAM-UNI-d1c3dd9f-18
0.434

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CC(=O)NCCc1c[nH]c2c(CN3CCN(C(=O)CCl)CC3)cccc12

DUN-NEW-f8ce3686-24
0.434

View
O=C(CCl)N1CCN(Cc2cc(F)cc(Cl)c2)CC1

SAD-SAT-581007d4-1
0.433

View
NS(=O)(=O)c1ccc2c(CN3CCN(C(=O)CCl)CC3)cc(F)cc2c1

DAR-DIA-fb20be43-12
0.430

View
Cc1cccc(CN2CCN(C(=O)CCl)CC2)c1C(=O)N1CCC(O)CC1

MAK-UNK-e4a48a85-26
0.430

View
O=C(CCl)N1CCN(Cc2cc(Cl)cc3cnccc23)CC1

JOO-PER-58e158bd-1
0.429

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

MAK-UNK-7c9d1431-29
0.429

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

MED-COV-4280ac29-37
0.427

View
O=C(CCl)N1CCN(Cc2ccc(Cl)s2)CC1

AAR-POS-0daf6b7e-2
0.424

View
O=C(CCl)N1CCN(Cc2ccco2)CC1

MAK-UNK-7c9d1431-28
0.424

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

MAT-POS-ee51dedd-1
0.423

View
C=CC(=O)N1CCN(Cc2cc(Cl)cc3ccccc23)CC1

MAT-POS-4e253971-2
0.421

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O=C(CCl)N1CCN(Cc2cccc3ccccc23)CC1c1cnc2[nH]cccc1-2

MIH-UNI-e573136b-1
0.421

View
O=C(CCl)N1CCN(Cc2ccc(-c3ccc4ccccc4c3CBr)s2)CC1

MAK-UNK-c74072e5-2
0.419

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CC(=O)N1CCCc2cccc(CN3CCN(C(=O)CCl)CC3)c2C1

TAM-UNI-d1c3dd9f-13
0.418

View
CNC(=O)c1cc2cccc(CN3CCN(C(=O)CCl)CC3)c2nc1N1CCN(C)CC1

BOG-INS-0b2b845a-1
0.416

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NS(=O)(=O)Cc1nc2cccc(CN3CCN(C(=O)CCl)CC3)c2[nH]1

STU-CHA-0f79177c-1
0.415

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O=C(CCl)N1CCN(Cc2c(F)cccc2Cl)CC1

AHN-SAT-de2502ba-15
0.414

View
O=C1Cc2c(cccc2CN2CCN(C(=O)CCl)CC2)CCN1

TAM-UNI-d1c3dd9f-14
0.412

View
CNC(=O)c1cc2cccc(CN3CCN(C(=O)CCl)CC3)c2nc1N1CCOCC1

BOG-INS-bdba9cfb-1
0.411

View
O=C(CCl)N1CCN(Cc2cnc(-c3ccccc3)nc2)CC1

MAK-UNK-af83ef51-1
0.411

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CCNc1ccc(C#N)cc1CN1CCN(C(=O)CCl)CC1

DAR-DIA-fb20be43-3
0.410

View
O=C(CCl)N1CCN(Cc2ccsc2)CC1

MAK-UNK-212f693e-8
0.409

View
O=C(CCl)N1CCN(Cc2ccsc2)CC1

AAR-POS-0daf6b7e-13
0.409

View
O=C(CCl)N1CCN(Cc2ccsc2)CC1

LON-WEI-8f408cad-7
0.409

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

JOK-SYG-18591e8f-1
0.408

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NC(=O)C1CCCN1c1ccccc1CN1CCN(C(=O)CCl)CC1

TAM-UNI-d1c3dd9f-9
0.407

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O=C1NCCCc2cccc(CN3CCN(C(=O)CCl)CC3)c21

TAM-UNI-d1c3dd9f-15
0.407

View
NC(=O)C1CCCN1c1ccccc1CN1CCN(C(=O)CCl)CC1

DUN-NEW-f8ce3686-2
0.407

View
N#Cc1ccc(CN2CCN(C(=O)CCl)CC2)cc1

MAK-UNK-6ca90168-14
0.403

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

SAD-SAT-65574d3f-10
0.403

View
O=C(CCl)N1CCN(Cc2cc(O)cc3c2OCO3)CC1

NEH-REV-107bcf72-3
0.400

View
O=C(CCl)N1CCN(Cc2cc(Cl)cc(Cl)c2)CC1

PAU-UNI-8cdd41c7-1
0.400

View
N#Cc1cccc(CN2CCN(C(=O)CCl)CC2)c1C(=O)N1CCC(O)CC1

MAK-UNK-10dfa458-38
0.398

View
CNC(=O)c1ccc(C#N)cc1CN1CCN(C(=O)CCl)CC1

TAM-UNI-d1c3dd9f-17
0.397

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

MAR-LAB-ca4662a6-2
0.397

View
O=C(CCl)N1CCN(Cc2ccc(Br)s2)CC1

AAR-POS-0daf6b7e-12
0.397

View
O=C(CCl)N1CCN(Cc2ccc(Br)s2)CC1

JOH-UNI-27ac80fd-23
0.397

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

JIA-UNI-93b03cae-1
0.391

View
NS(=O)(=O)CCNc1ncccc1CN1CCN(C(=O)CCl)CC1

STU-CHA-464c0256-1
0.390

View
Cc1nc(CN2CCN(C(=O)CCl)CC2)cs1

SAD-SAT-5b1897b2-2
0.386

View
N#Cc1ccsc1CN1CCN(C(=O)CCl)CC1

DAV-CRI-d1e0885a-1
0.384

View
O=C(CCl)N1CCN(Cc2ccc3c(c2)OCO3)CC1

MAK-UNK-7c9d1431-14
0.384

View
O=C(CCl)N1CCN(Cc2ccc3c(c2)OCCO3)CC1

MAR-TRE-6a44bbf2-54
0.384

View
O=C(CCl)N1CCN(Cc2ccc3c(c2)OCCO3)CC1

MAK-UNK-7c9d1431-16
0.384

View
O=C(C(F)Cl)N1CC2CC1CN2Cc1cccc2ccccc12

MAK-UNK-90d0606b-7
0.383

View
O=C(CCl)N1CCN(Cc2nc(-c3cccs3)no2)CC1

NAU-LAT-64f4b287-3
0.380

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

DAR-DIA-fb20be43-1
0.380

View
N#Cc1cnc(CCO)cc1CN1CCN(C(=O)CCl)CC1

MED-COV-4280ac29-35
0.380

View
O=C(CCl)N1CCN(Cc2cnc(Cc3ccccc3)s2)CC1

MED-COV-4280ac29-25
0.380

View
Nc1nc(CN2CCN(C(=O)CCl)CC2)ncc1Cc1ccccc1

MED-COV-4280ac29-19
0.378

View
O=C(CCl)N1CCN(Cc2cn(Cc3ccccc3)nn2)CC1

STE-KUL-2e0d2e88-7
0.377

View
CN(C)C(=O)c1ccc(CNS(C)(=O)=O)c(CN2CCN(C(=O)CCl)CC2)c1

TAM-UNI-d1c3dd9f-4
0.373

View
CNC(=O)C(NCCNC(C)=O)c1cccc(CN2CCN(C(=O)CCl)CC2)c1

MAK-UNK-176ca439-2
0.372

View
O=C(CCl)N1CCN([C@@H](c2cccc3ccccc23)N2CCCOCC2)CC1

JOO-IND-3132366c-1
0.372

View
CNC(=O)C(CCN1CCN(C(=O)CCl)CC1)Nc1ccccc1

MED-COV-dea4df70-1
0.372

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

AHN-SAT-de2502ba-14
0.371

View
O=C(CCl)N1CCN(Cc2cc(O)cc(Cl)c2)CC1

SAD-SAT-581007d4-7
0.371

View
Cc1cc(Cl)cc(CN2CCN(C(=O)CCl)CC2)c1

SAD-SAT-581007d4-2
0.371

View
O=C(CCl)N1CCN(Cc2cc(O)cc(Cl)c2)CC1

MAT-POS-2db6411e-2
0.371

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

SAD-SAT-65574d3f-1
0.371

View
CCc1ccccc1NC(=O)CN1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-27
0.368

View
CC(=O)NCCc1c[nH]c2c(CN3CCN(C(=O)CCl)CC3)cc(F)cc12

NAU-LAT-f723e322-1
0.368

View
CC(=O)NCCc1c[nH]c2c(CN3CCN(C(=O)CCl)CC3)cc(F)cc12

DAR-DIA-fb20be43-11
0.368

View
CC(=O)NCCc1c[nH]c2c(CN3CCN(C(=O)CCl)CC3)cc(F)cc12

STU-CHA-bc0a9883-1
0.368

View
O=C(CCl)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

1.000

View
O=C(CO)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.772

View
NCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.759

View
CCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.759

View
NCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.746

View
CCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.733

View
CC(=O)CCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.733

View
CSCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.733

View
CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.732

View
CC(C)(C)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.721

View
COCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.721

View
CC(C)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.721

View
N#CCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.721

View
NC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.719

View
O=C(CC(F)(F)F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.710

View
CN(C)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.710

View
O=C(CC1CC1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.710

View
NC(=O)CCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.710

View
NOCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.710

View
CNCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.710

View
C=CCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.703

View
CS(=O)(=O)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.698

View
CC(C)(O)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.698

View
O=C(CC1=CC=CC=C1F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.692

View
CC(C)(C)OCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.692

View
NC(=O)CN1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.692

View
O=C(CN1CCCC1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
CC(C)CCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
CC(F)(F)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
CCCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
O=C(CCC(F)F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
CC(N)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
C[C@@H](N)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
C[C@H](N)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
NCCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
NC(=O)CSCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
COCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
COC(=O)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
CC(=O)CCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
CN(C)C(=O)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
CC(=O)NCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
O=C(CC1CCC1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.688

View
O=C(CC1CC1(Cl)Cl)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.682

View
O=C(CN1C(=O)CCC1=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.682

View
O=C(CC1=CC=CC=C1CO)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
O=C(CN1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1)N1CCCC1

0.677

View
O=C(CCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCOCC1

0.677

View
O=C(CCC(F)(F)F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
O=C(CCCCO)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
O=C(CC1=CC=CC=C1O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
CC(=O)N1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.677

View
CC1(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.677

View
C#CCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
O=C(CSC(F)(F)F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
CCN(CC)CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
CCOCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
CSCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
NC(=O)CCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.677

View
O=C(C(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCC1

0.672

View
NC(=O)C(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.672

View
O=C(CN1CCNCC1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.672

View
O=C(CN1CCCC1)N1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.667

View
O=C(CC1=CC=C(F)C=C1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.667

View
CCN1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.667

View
O=C(CO)N1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.667

View
O=C(O)COCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.667

View
NC1=CC=CC=C1CC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.667

View
CCCCCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.667

View
O=C(CC1CCCC1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.667

View
O=C(CCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCC(O)CC1

0.667

View
O=C(COC(F)F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.667

View
O=C(CN1CCS(=O)(=O)CC1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.662

View
O=C(C(F)F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.661

View
O=C(COC1=CC=CC=C1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.657

View
O=C(CN1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1)N1CCCCCC1

0.657

View
O=C(CN1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1)N1CCCCC1

0.657

View
CN1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.657

View
CCC(=O)N1CCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.657

View
O=C(CCN1C=CC=C1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.657

View
O=C1CC(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)C1

0.657

View
O=C(CCCCCO)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.657

View
O=C(CSCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCCCC1

0.657

View
CCC(=O)N1CCCN(CC2=CC=CC3=CC=CC=C23)CC1

0.652

View
O=C(CN1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCC1

0.651

View
O=C(N1CCCC1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.651

View
O=C(C(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCCC1

0.651

View
O=C(CCC1=CC=CC=C1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.647

View
O=C(CC1(C(F)(F)F)CC1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.647

View
O=C(COCC(F)(F)F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.647

View
O=C(CCC(=O)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1)C1=CC=CC=C1

0.647

View
O=C(CCC1=CC=CC=C1F)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.643

View
O=C(CN1CCCN(CC(=O)N2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1)N1CCCC1

0.638

View
CC(=O)N1CCN(C(=O)CN2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.636

View
O=C(N1CCN(CC2=CC=CC3=CC=CC=C23)CC1)C12CC(F)(C1)C2

0.636

View
O=C(CN1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCCC1

0.631

View
O=C(C1=CC=CC=C1)N1CCN(CC2=CC=CC3=CC=CC=C23)CC1

0.631

View
CN1CCN(C(=O)CN2CCN(CC3=CC=CC4=CC=CC=C34)CC2)CC1

0.618

View
O=C(CN1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCCCCC1

0.612

View
O=C(CN1CCN(CC2=CC=CC3=CC=CC=C23)CC1)N1CCCCC1

0.612

View
O=C(CCl)N1CCN(CC2=CC=CC=C2Cl)CC1

0.532

View
Cl.ClCC(=O)N1CCN(Cc2cccc3ccccc23)CC1

0.981

View
CC(=O)N1CCN(Cc2cccc3ccccc23)CC1

0.732

View
O=C(N1CCN(Cc2cccc3ccccc23)CC1)c1ccccc1

0.631

View
ClCC(=O)N1CCN(Cc2ccccc2)CC1

0.483

View
Cl.ClCC(=O)N1CCN(Cc2ccccc2)CC1

0.475

View
O=C(N1CCN(Cc2ccccc2)CC1)c1cccc2ccccc12

0.382

View
O=C(N1CCN(CC1)C(=O)c1cccc2ccccc12)c1cccc2ccccc12

0.343

View
CCN1CCN(CC1)C(=O)c1cccc2ccccc12

0.342

View
O=C(NCCN1CCN(CC1)C(=O)c1cccc2ccccc12)c1cccc2ccccc12

0.333

View
CN1CCN(CC1)C(=O)c1cccc2ccccc12

0.311

View
Cl.O=C(N1CCNCC1)c1cccc2ccccc12

0.307

View
O=C(N1CCN(CC1)C(=O)c1cccc2ccccc12)c1ccccc1

0.295

View
ClC(Cl)C(=O)N1CCN(Cc2ccccc2)CC1

0.290

View
ClC(Cl)(Cl)C(=O)N1CCN(Cc2ccccc2)CC1

0.286

View
N1(CC2C3C(=CC=CC=3)C=CC=2)CCN(C(C)=O)CC1

0.732

View
N1(CC2C3C(=CC=CC=3)C=CC=2)CCN(C(=O)C2=CC=CC=C2)CC1

0.631

View
N1(CC2C3C(=CC=CC=3)C=CC=2)CCN(C=O)CC1

0.600

View
N1(CC2C3C(=CC=CC=3)C=CC=2)CCN(CC)CC1

0.593

View
N1(CC2C3C(=CC=CC=3)C=CC=2)CCN(C)CC1

0.593

View
N1(CC2C3C(=CC=CC=3)C=CC=2)CCN(CC(NC(C)C)=O)CC1

0.559

View
C(N1C(=O)CN(CC2C3C(=CC=CC=3)C=CC=2)CC1)(=O)C

0.500

View
N1(CC2C3C(=CC=CC=3)C=CC=2)CCN(C)C(=O)C1

0.485

View
N(CC1C2C(=CC=CC=2)C=CC=1)(C)CC(N1CCN(C)CC1)=O

0.427

View
C(N(C)CC1C2C(=CC=CC=2)C=CC=1)(=O)CN1CCN(C(C)=O)CC1

0.403

View
N1(CC2=C3C=CC=C(C)C3=CC=C2)CCN(C(C)=O)CC1

0.394

View
N1(CC2=C3C(C=CC=C3)=CC3C2=CC=CC=3)CCN(C(C)=O)CC1

0.386

View
N1(CC2=C(C)C=CC3=C2C=CC=C3)CCN(C(C)=O)CC1

0.384

View
C(N1CCN(CC)CC1)(C1C2C(=CC=CC=2)C=CC=1)=O

0.342

View
C(N1CCN(CCC)CC1)(=O)C1C2C(=CC=CC=2)C=CC=1

0.325

View
N1(CC2=C3C=CC=C(C)C3=CC=C2)CCN(C=O)CC1

0.320

View
N(CC1C2C(=CC=CC=2)C=CC=1)(CC(N(CC)CC)=O)C

0.320

View
N1(CC2C=CC3=C(C=CC=C3)C=2)CCN(C(C)=O)CC1

0.311

View
C(N1CCN(C)CC1)(=O)C1C2C(=CC=CC=2)C=CC=1

0.311

View
N1(CC2C=CC3=C(C=CC=C3)C=2)CCN(C=O)CC1

0.218

View

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