Molecule Details

Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1
piperazine-chloroacetamide Enamine Mcule MolPort Assayed
View on Fragalysis x1336
Molecular Properties
SMILES:
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1
MW: 330.837
Fraction sp3: 0.5
HBA: 3
HBD: 0
Rotatable Bonds: 3
TPSA: 57.69
cLogP: 1.37514
Covalent Warhead: ✔️
Covalent Fragment: ✔️
Source
Enamine BB: EN300-22818
Enamine SCR: Z147647422
Enamine REAL: Z166605410
Enamine Extended REAL: m_270062____7595242____8147258
Mcule: MCULE-7926314722
MolPort: MolPort-002-470-576
Activity Data
IC50 (µM) - Fluorescence: 14.2164854520191
IC50 (µM) - RapidFire: 1.62336890299448
Trypsin IC50 (µM): 99.0
pIC50 (µM) - Fluorescence 4.84720775504424
Average Inhibition @ 50 µM - Fluorescence: 101.1492
Average Inhibition @ 20 µM - RapidFire: 90.8478520270466
Average Inhibition @ 50 µM - RapidFire: 96.2866818206516
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

Hetero_hetero

Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1

WAR-XCH-79d12f6e-6
1.000

View
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1

MAR-TRE-6a44bbf2-13
1.000

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Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c(C)c1

AAR-POS-d2a4d1df-36
0.661

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

AAR-POS-d2a4d1df-27
0.550

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

MAR-TRE-6a44bbf2-68
0.550

View
Cc1ccc(NCc2ccccc2)c(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1

NAU-LAT-f723e322-5
0.548

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

MAK-UNK-7c9d1431-8
0.524

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

MAR-TRE-6a44bbf2-26
0.524

View
C=CC(=O)NCc1ccc(C(=O)N2CCN(S(=O)(=O)c3cc(C)ccc3C)CC2)cc1

SAD-SAT-2ceae68f-3
0.519

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1

MAK-UNK-7c9d1431-12
0.516

View
Cc1ccc(C)c(S(=O)(=O)N2CC3CC2CN3C(=O)CCl)c1

MAK-UNK-3f402c2b-17
0.500

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

AAR-POS-d2a4d1df-34
0.500

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

MAR-TRE-6a44bbf2-8
0.500

View
Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N1CCN(C(=O)C2CCN(C(=O)CCl)CC2)CC1

SAD-SAT-9a6c5cf3-7
0.500

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

MAR-TRE-6a44bbf2-45
0.493

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

MAK-UNK-7c9d1431-30
0.493

View
CC(=O)c1cccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1

MAR-TRE-6a44bbf2-65
0.493

View
CC(=O)c1cccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1

TAT-ENA-80bfd3e5-43
0.493

View
CC(=O)c1cccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)c1

MAK-UNK-7c9d1431-11
0.493

View
Cc1cc(C)cc(-c2ccc(S(=O)(=O)N3CCN(C(=O)CCl)CC3)s2)c1

NIM-UNI-05f93fcc-7
0.486

View
O=C(CCl)N1CCN(S(=O)(=O)c2cc(Cl)cc(Cl)c2)CC1

SAD-SAT-bc31ec01-5
0.484

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

MAK-UNK-d4768348-1
0.476

View
CC(=O)NCCc1c[nH]c2ccc(CC(=O)N3CCN(S(=O)(=O)c4cc(C)ccc4C)CC3)cc12

JAR-IMP-ed466bb3-19
0.473

View
Cc1ccc(-c2ccc(S(=O)(=O)N3CCN(C(=O)CCl)CC3)s2)cc1

NIM-UNI-05f93fcc-11
0.471

View
N#Cc1ccccc1S(=O)(=O)N1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-7
0.471

View
N#Cc1ccccc1S(=O)(=O)N1CCN(C(=O)CCl)CC1

AAR-POS-d2a4d1df-37
0.471

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1

MAR-TRE-6a44bbf2-32
0.470

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1

ABB-MCD-f8003a30-1
0.470

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

MAK-UNK-7c9d1431-13
0.469

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

MAR-TRE-6a44bbf2-78
0.469

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

MAR-TRE-6a44bbf2-21
0.468

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

MAK-UNK-7c9d1431-9
0.468

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

MAR-TRE-6a44bbf2-18
0.462

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

LON-WEI-8f408cad-4
0.462

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

AAR-POS-d2a4d1df-23
0.462

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

AAR-POS-d2a4d1df-44
0.460

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

MAK-UNK-7c9d1431-17
0.455

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1

KAY-MCD-d0fe5261-1
0.453

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

LON-WEI-8f408cad-3
0.453

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

MAR-TRE-6a44bbf2-52
0.453

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

AAR-POS-0daf6b7e-15
0.453

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

MAT-POS-ee51dedd-2
0.453

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

AAR-POS-d2a4d1df-22
0.453

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

SAD-SAT-3a925b8b-2
0.453

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1

MAR-TRE-6a44bbf2-58
0.453

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

MAK-UNK-7c9d1431-19
0.449

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1

MAK-UNK-7c9d1431-10
0.448

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

NIM-UNI-05f93fcc-1
0.446

View
O=C(CCl)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1

LON-WEI-8f408cad-2
0.446

View
O=C(CCl)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1

MAR-TRE-6a44bbf2-4
0.446

View
O=C(CCl)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1

AAR-POS-d2a4d1df-32
0.446

View
CS1=CC(S(=O)(=O)N2CCN(C(=O)CCl)CC2)=CC1

MAK-UNK-d4768348-7
0.439

View
Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)CCl)CC1

MAR-TRE-6a44bbf2-24
0.439

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

MAK-UNK-7c9d1431-22
0.435

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(C3CC3)cc2)CC1

MAK-UNK-c74072e5-8
0.433

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

MAK-UNK-7c9d1431-6
0.433

View
O=C(CCl)N1CCN(S(=O)(=O)C2=CCC=C2)CC1

SAD-SAT-3a925b8b-9
0.431

View
O=C(CCl)N1CCN(S(=O)(=O)C2=CC[SH]=N2)CC1

MAK-UNK-d4768348-4
0.431

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1

MAR-TRE-6a44bbf2-31
0.431

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1

MAR-TRE-6a44bbf2-49
0.431

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1

MAK-UNK-7c9d1431-7
0.431

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1

MAK-UNK-7c9d1431-5
0.431

View
O=C(CCl)N1CCN(S(=O)(=O)c2cpcc(Cl)c2)CC1

SAD-SAT-bc31ec01-4
0.426

View
O=C(CCl)N1CCN(S(=O)(=O)C2=C3CC3[SH]=C2)CC1

SAD-SAT-3a925b8b-7
0.426

View
C=CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C)CC1

JAN-GHE-4287bd1a-1
0.426

View
O=C(CCl)N1CCN(S(=O)(=O)C2=C(Cl)CC=C2)CC1

SAD-SAT-3a925b8b-6
0.424

View
O=C(CCl)N1CCN(S(=O)(=O)C2=CCS(O)=C2)CC1

MAK-UNK-d4768348-8
0.424

View
O=C(CCl)N1CCN(S(=O)(=O)c2cocn2)CC1

SAD-SAT-3a925b8b-3
0.424

View
O=C(CCl)N1CCN(S(=O)(=O)C2=CCN=C2)CC1

MAK-UNK-d4768348-5
0.424

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

MAK-UNK-d4768348-2
0.424

View
Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)N3CCCC(c4nc5ccccc5s4)C3)CC2)c1

JAR-IMP-ed466bb3-15
0.419

View
O=C(CCl)N1CCCN(S(=O)(=O)c2cc(F)ccc2F)CC1

BEN-DND-76ad4ac9-10
0.419

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

MAK-UNK-d4768348-3
0.418

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

IND-SYN-6c8299e8-2
0.417

View
O=C(CCl)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1

TAT-ENA-80bfd3e5-25
0.417

View
O=C(CCl)N1CCCN(S(=O)(=O)c2ccccc2F)CC1

BEN-DND-76ad4ac9-11
0.417

View
O=C(CCl)N1CCCN(S(=O)(=O)c2cccc(F)c2)CC1

BEN-DND-76ad4ac9-14
0.417

View
O=C(CCl)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1

MAK-UNK-7c9d1431-4
0.417

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1

MAK-UNK-7c9d1431-3
0.417

View
C=CC(=O)N(C)CC(=O)N1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)CC1

SAD-SAT-2ceae68f-5
0.415

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

SWA-SYN-6423ea73-5
0.413

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

SWA-SYN-d2e6fa14-5
0.413

View
COS1=CC(S(=O)(=O)N2CCN(C(=O)CCl)CC2)=CC1

MAK-UNK-d4768348-9
0.408

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3cncnc3)s2)CC1

NIM-UNI-310206f0-67
0.408

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccccc3)s2)CC1

NIM-UNI-05f93fcc-2
0.405

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1

MAR-TRE-6a44bbf2-38
0.405

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1

MAK-UNK-7c9d1431-1
0.405

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

MAR-TRE-6a44bbf2-28
0.403

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

MAK-UNK-7c9d1431-23
0.403

View
O=C(CCl)N1CCCN(S(=O)(=O)c2c(F)cccc2F)CC1

BEN-DND-76ad4ac9-12
0.403

View
O=C(CCl)N1CCCN(S(=O)(=O)c2cccs2)CC1

BEN-DND-76ad4ac9-13
0.403

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccc(O)cc3)s2)CC1

NIM-UNI-05f93fcc-14
0.400

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3ccncc3)s2)CC1

NIM-UNI-310206f0-69
0.400

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(-c3cccnc3)s2)CC1

NIM-UNI-05f93fcc-6
0.397

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

NIM-UNI-05f93fcc-15
0.397

View
Cc1ccc(S(=O)(=O)N2CCCN(C(=O)C3CCN(C(=O)CCl)CC3)CC2)cc1

SAD-SAT-9a6c5cf3-2
0.395

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc(OCC3CCOCC3)s2)CC1

NIM-UNI-310206f0-70
0.395

View
N#Cc1c(F)cccc1-c1ccccc1S(=O)(=O)N1CCN(C(=O)CCl)CC1

SAD-SAT-bc31ec01-10
0.395

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1

MAR-TRE-6a44bbf2-36
0.395

View
O=C(CCl)N1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1

MAK-UNK-7c9d1431-2
0.395

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCl)CC2)=C1

1.000

View
CCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.782

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CO)CC2)=C1

0.782

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CN)CC2)=C1

0.768

View
CSCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.754

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC(C)(C)C)CC2)=C1

0.754

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CS(C)(=O)=O)CC2)=C1

0.741

View
CCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.741

View
CC(=O)CCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.741

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CN(C)C)CC2)=C1

0.729

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCC3)CC2)=C1

0.729

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC(C)C)CC2)=C1

0.729

View
COCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.729

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCN)CC2)=C1

0.729

View
CNCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.729

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC(C)(C)O)CC2)=C1

0.729

View
CCS(=O)(=O)CC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.729

View
CC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.722

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)COC(C)(C)C)CC2)=C1

0.721

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3CC3)CC2)=C1

0.717

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC#N)CC2)=C1

0.717

View
COC(=O)CC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.717

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC(F)(F)F)CC2)=C1

0.717

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3(C)CC3)CC2)=C1

0.717

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CON)CC2)=C1

0.717

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC(C)(F)F)CC2)=C1

0.717

View
CNCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.717

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC(C)(C)N)CC2)=C1

0.717

View
C=CCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.710

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(N)=O)CC2)=C1

0.709

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCCC3)CC2)=C1

0.705

View
CC(=O)N1CCN(C(=O)CCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)CC1

0.705

View
CCCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.705

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCS(C)(=O)=O)CC2)=C1

0.705

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC(C)N)CC2)=C1

0.705

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)C[C@@H](C)N)CC2)=C1

0.705

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)C[C@H](C)N)CC2)=C1

0.705

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCNCC3)CC2)=C1

0.705

View
CNS(=O)(=O)CC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.705

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(C)(C)C)CC2)=C1

0.705

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC(=O)N(C)C)CC2)=C1

0.705

View
CCC(C)(C)CC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.705

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CS(=O)(=O)C(C)(C)C)CC2)=C1

0.705

View
CCC(CC)CC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.694

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCN(C)CC3)CC2)=C1

0.694

View
CCC(=O)N1CCN(C(=O)CCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)CC1

0.694

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CN3CCCC3)CC2)=C1

0.694

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(C)C)CC2)=C1

0.694

View
CCOCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.694

View
CSCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.694

View
CC(=O)NCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.694

View
CC(=O)CCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.694

View
COCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.694

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3CCC3)CC2)=C1

0.694

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CS(=O)(=O)C(C)C)CC2)=C1

0.694

View
CCN(CC)CC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.694

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCCN)CC2)=C1

0.694

View
CCNCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.694

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3CC3(Cl)Cl)CC2)=C1

0.688

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCCCCC3)CC2)=C1

0.683

View
CC1=CC=C(C)C(CC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)=C1

0.683

View
CC1=CC=C(CC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)C=C1

0.683

View
CCCCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.683

View
C#CCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.683

View
CCC(=O)N1CCCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.677

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCCCCCC3)CC2)=C1

0.672

View
CCN1CCN(C(=O)CCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)CC1

0.672

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3CCCC3)CC2)=C1

0.672

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3CC(=O)C3)CC2)=C1

0.672

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCC(=O)CC3)CC2)=C1

0.672

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCOCC3)CC2)=C1

0.672

View
COC(=O)CCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.672

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)COCC(=O)O)CC2)=C1

0.672

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCC(C)CC3)CC2)=C1

0.672

View
CCCCCCC(=O)N1CCN(S(=O)(=O)C2=CC(C)=CC=C2C)CC1

0.672

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3=CC=C(Cl)C=C3)CC2)=C1

0.667

View
CC1=CC=CC(CC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)=C1

0.667

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCCOC(C)(C)C)CC2)=C1

0.667

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3=CC=C(C)C(C)=C3)CC2)=C1

0.662

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCSCC3)CC2)=C1

0.662

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3=CC=CC=C3)CC2)=C1

0.662

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)N3CCC3)CC2)=C1

0.661

View
CC1=CC=C(C)C(S(=O)(=O)NCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)=C1

0.652

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCS(=O)CC3)CC2)=C1

0.652

View
COC(=O)N1CCN(C(=O)CCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)CC1

0.652

View
CC1=CC=C(C)C(S(=O)(=O)NCCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)=C1

0.642

View
CC1=CC=C(OCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)C=C1

0.642

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3=C(F)C=CC=C3F)CC2)=C1

0.642

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)N3CCCC3)CC2)=C1

0.639

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(S(=O)(=O)CCl)CC2)=C1

0.638

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CC3=CC=CC(Cl)=C3)CC2)=C1

0.638

View
CC1=CC=C([N+](=O)[O-])C=C1S(=O)(=O)N1CCN(C(=O)CCl)CC1

0.635

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)CCC(=O)N3CCSC3)CC2)=C1

0.632

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)COC3=CC=CC=C3)CC2)=C1

0.632

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)COC3=CC=C(Cl)C=C3)CC2)=C1

0.629

View
CC1=CC=CC=C1S(=O)(=O)N1CCN(C(=O)CCl)CC1

0.627

View
CC1=CC=C(C)C(C(=O)CCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)=C1

0.623

View
CC1=CC=C(OCCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)C=C1

0.623

View
CC1=CC=C(C)C(S(=O)(=O)N2CCN(C(=O)N3CCCCC3)CC2)=C1

0.619

View
CC1=CC=C(S(=O)(=O)NCC(=O)N2CCN(S(=O)(=O)C3=CC(C)=CC=C3C)CC2)C=C1

0.614

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)CCl

1.000

View
CCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.782

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)CC(C)(C)C

0.754

View
CC(C)CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.729

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.722

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)CCC(O)=O

0.717

View
CCN(CC)CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.694

View
CCOCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.694

View
CN(CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C)S(N)(=O)=O

0.694

View
CCC(=O)N1CCN(CC1)C(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.694

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)CCCC(O)=O

0.683

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)C(C)(C)C

0.672

View
CNC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.672

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)CN1CCCCC1

0.672

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)Cc1ccccc1

0.662

View
CC(C)C(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.661

View
Cc1ccc(c(C)c1)S(=O)(=O)N1CCN(CC1)C(=O)CCl

0.661

View
CC1CC1C(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.656

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)C(F)(F)F

0.650

View
CCN(CC)C(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.642

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)CSc1ccccc1

0.642

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)C1CC1

0.639

View
CC1CCN(CC(=O)N2CCN(CC2)S(=O)(=O)c2cc(C)ccc2C)CC1

0.632

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)CCC(=O)N1CCN(CC1)C(=O)C1CC1

0.632

View
CCCNC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.625

View
CC(=O)N1CCC(CCC(=O)N2CCN(CC2)S(=O)(=O)c2cc(C)ccc2C)CC1

0.623

View
CC(C)CCNC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.620

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)C1CCC1

0.619

View
CN1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.607

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC(O)=O)CC1

0.607

View
CCC(CC)NC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.606

View
CCN1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.603

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccccc1

0.600

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)C1CCCC1

0.600

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CCO)CC1

0.590

View
CCCN1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.574

View
CCN(C1CCCC1)C(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.566

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C#N

0.557

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCNCC1

0.552

View
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)CCl

0.550

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CCC#N)CC1

0.530

View
Cc1ccc(cc1C)S(=O)(=O)N1CCN(CC1)C(=O)CCl

0.524

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC(=O)NCC=C)CC1

0.514

View
CC(C)CNC(=O)CN1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.514

View
Cc1ccc(C)c(c1)S(=O)(=O)NCCN1CCN(CC1)S(=O)(=O)c1cc(C)ccc1C

0.493

View
CC(=O)c1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)CCl

0.493

View
ClCC(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1C#N

0.471

View
CC(C)N1CCN(CC1=O)S(=O)(=O)c1cc(C)ccc1C

0.470

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(ccc1C)C(C)(C)C

0.469

View
ClCC(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1

0.468

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCNC(=O)C1

0.462

View
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(C2CC2)C(=O)C1

0.449

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)ccc1F

0.439

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)c(Cl)cc1C

0.438

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)c(Br)cc1C

0.394

View
CCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(C)c(C)c1

0.391

View
CC(C)CC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(C)c1

0.370

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(C)c(C)c(C)c1C

0.353

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(Cl)c(C)c1

0.353

View
CCCC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C

0.352

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1cc(cc(C)c1C)C(C)(C)C

0.348

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(C)c(C)c1

0.338

View
CCCCC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C

0.338

View
CC(=O)NCCNS(=O)(=O)c1cc(C)ccc1C

0.333

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)cc(C)cc1C

0.333

View
CCN1CCN(CC1)S(=O)(=O)c1cc(C)c(C)cc1C

0.328

View
CSCCC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C

0.315

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C

0.313

View
CCC(=O)NCC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C

0.311

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(I)c(C)c1

0.306

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(F)c(C)c1

0.306

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(Br)c(C)c1

0.306

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1C#N

0.301

View
Cc1cccc(c1)S(=O)(=O)N1CCN(CC(N)=O)CC1

0.293

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C

0.292

View
Cc1cc(C)c(C)c(c1C)S(=O)(=O)N1CCN(CC1)C(=O)C(C)(C)C#N

0.286

View
Cc1cc(C)c(C)c(c1C)S(=O)(=O)N1CCN(CC1)C(=O)C1CC1

0.284

View
Cc1cc(C)c(C)c(c1C)S(=O)(=O)N1CCN(CC1)C(=O)C1CCC1

0.276

View
CC(C)C(=O)N1CCN(CC1)S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C

0.271

View
CN(C)C(=O)CN1CCN(CC1)C(=O)CN1CCN(CC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C

0.271

View
Cc1c(C)c(C)c(c(C)c1C)S(=O)(=O)N1CCN(CC1)C(=O)C1CC1

0.268

View
CCN1CCN(CC1)S(=O)(=O)c1cccc(C)c1

0.264

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(c1)C#N

0.260

View
CN1CCN(CC1)S(=O)(=O)c1cccc(C)c1

0.257

View
CCC(=O)NC(C)C(=O)N1CCN(CC1)S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C

0.253

View
Cc1cc(C)c(C)c(c1C)S(=O)(=O)N1CCN(CCO)CC1

0.243

View
CC(=O)N1CCN(CCNS(=O)(=O)c2c(C)c(C)cc(C)c2C)CC1

0.241

View
CCN1CCN(CC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C

0.239

View
Cc1cc(C)c(C)c(c1C)S(=O)(=O)N1CCN(CCCO)CC1

0.234

View
CN1CCN(CC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C

0.232

View
CCCN1CCN(CC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C

0.230

View
CCCNC(=O)C(C)NC(=O)CN1CCN(CC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C

0.217

View
CCN(CC)C(=O)CN1CCN(CC1)S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C

0.215

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(C(C)=O)CC1

0.722

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(C(=O)C2CC2)CC1

0.639

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(C)CC1

0.607

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(CC)CC1

0.603

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(C(=O)C2=CC=CC=C2)CC1

0.600

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(C=O)CC1

0.576

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(C(C)C)CC1

0.576

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(CC#N)CC1

0.556

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(CCCC)CC1

0.547

View
C(N1C(=O)CN(S(=O)(=O)C2=C(C)C=CC(C)=C2)CC1)(=O)CC

0.522

View
N1(S(=O)(=O)C2=C(C)C=CC(C)=C2)CCN(C)C(=O)C1

0.508

View
C(N1C(=O)CN(S(=O)(=O)C2=C(C)C=CC(C)=C2)CC1)(=O)C

0.508

View
C(N1C(=O)CN(S(=O)(=O)C2=C(C)C=CC(C)=C2)CC1)(C(Cl)Cl)=O

0.493

View
N1(S(=O)(=O)C2=C(C)C=CC(Cl)=C2)CCN(C(C)=O)CC1

0.484

View
C(N1C(=O)CN(S(=O)(=O)C2=C(C)C=CC(C)=C2)CC1)(=O)C#C

0.471

View
C(N1CCN(S(C)(=O)=O)CC1)(=O)CNS(C1C(C)=CC=C(C)C=1)(=O)=O

0.458

View
N1(S(=O)(=O)C2=C(C)C=C(Cl)C(C)=C2)CCN(C(C)=O)CC1

0.438

View
N1(S(=O)(=O)C2C=CC(C)=CC=2C)CCN(C(C)=O)CC1

0.438

View
N1(S(=O)(=O)C2=C(C)C=C(Cl)C(C)=C2)CCN(C=O)CC1

0.333

View
N1(S(=O)(=O)C2=C(C#N)C=CC=C2)CCN(C(C)=O)CC1

0.301

View

Discussion: