Molecule Details

O=C(CCl)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1
piperazine-chloroacetamide Enamine Mcule MolPort Assayed
View on Fragalysis x0691
Molecular Properties
SMILES:
O=C(CCl)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1
MW: 320.773
Fraction sp3: 0.42
HBA: 3
HBD: 0
Rotatable Bonds: 3
TPSA: 57.69
cLogP: 0.8974
Covalent Warhead: ✔️
Covalent Fragment:
Source
Enamine BB: EN300-22860
Enamine SCR: Z147647642
Enamine REAL: Z147647642
Mcule: MCULE-9354217329
MolPort: MolPort-002-470-580
Activity Data
IC50 (µM) - Fluorescence: 4.55048873816837
IC50 (µM) - RapidFire: 2.02356071032967
Trypsin IC50 (µM): 99.0
pIC50 (µM) - Fluorescence 5.34194195611417
Average Inhibition @ 20 µM - Fluorescence: 97.289005
Average Inhibition @ 50 µM - Fluorescence: 103.54665
Average Inhibition @ 20 µM - RapidFire: 96.62
Average Inhibition @ 50 µM - RapidFire: 96.84
Relative Solubility @ 20 µM: 1.0
Relative Solubility @ 100 µM: 1.0
Order Status
Shipped: 2020-04-17

Activated haloaromatics

Hetero_hetero

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

LON-WEI-8f408cad-4
1.000

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

AAR-POS-d2a4d1df-23
1.000

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

BEN-DND-76ad4ac9-14
0.800

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

DAN-MCD-50ec7d1f-1
0.769

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

IND-SYN-6c8299e8-2
0.707

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CC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1

MAK-UNK-6435e6c2-5
0.692

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

MAR-TRE-6a44bbf2-65
0.672

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

MAK-UNK-7c9d1431-11
0.672

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

TAT-ENA-80bfd3e5-43
0.672

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

MAK-UNK-7c9d1431-4
0.650

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

TAT-ENA-80bfd3e5-25
0.650

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

ABB-MCD-f8003a30-1
0.649

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

MAK-UNK-7c9d1431-10
0.649

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

MAR-TRE-6a44bbf2-32
0.649

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

DAN-MCD-5c762fbe-1
0.643

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

MAK-UNK-10dfa458-5
0.643

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O=C(CCl)C1CCN(S(=O)(=O)c2cccc(F)c2)CC1

BEN-DND-76ad4ac9-6
0.643

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

MAR-TRE-6a44bbf2-58
0.636

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

KAY-MCD-d0fe5261-1
0.636

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N#CC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1

MAK-UNK-10dfa458-29
0.632

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

MAK-UNK-7c9d1431-9
0.630

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

MAR-TRE-6a44bbf2-21
0.630

View
O=C(Cn1cccn1)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1

IND-SYN-6c8299e8-7
0.625

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

MAK-UNK-7c9d1431-8
0.603

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

MAR-TRE-6a44bbf2-26
0.603

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

MAK-UNK-7c9d1431-3
0.571

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

LON-WEI-8f408cad-2
0.569

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

MAR-TRE-6a44bbf2-4
0.569

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

AAR-POS-d2a4d1df-32
0.569

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

MAK-UNK-7c9d1431-19
0.565

View
O=C(CCl)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1O

MAC-MCD-4707377b-1
0.562

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

SAD-SAT-bc31ec01-5
0.561

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

AAR-POS-d2a4d1df-44
0.561

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

MAT-POS-ee51dedd-2
0.552

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

SAD-SAT-3a925b8b-2
0.552

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

MAR-TRE-6a44bbf2-68
0.552

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

AAR-POS-d2a4d1df-27
0.552

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

MAK-UNK-7c9d1431-13
0.542

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

MAR-TRE-6a44bbf2-78
0.542

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

MAR-TRE-6a44bbf2-31
0.538

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

MAR-TRE-6a44bbf2-49
0.538

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

MAK-UNK-7c9d1431-5
0.538

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

MAK-UNK-7c9d1431-7
0.538

View
O=C(CCl)N1CCC(S(=O)(=O)c2cccc(F)c2)CC1

BEN-DND-76ad4ac9-7
0.532

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

MAR-TRE-6a44bbf2-38
0.530

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

MAK-UNK-7c9d1431-1
0.530

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

AAR-POS-d2a4d1df-34
0.525

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

MAK-UNK-c74072e5-8
0.525

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

MAK-UNK-7c9d1431-6
0.525

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

MAK-UNK-7c9d1431-17
0.525

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

MAR-TRE-6a44bbf2-8
0.525

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

SAD-SAT-bc31ec01-4
0.516

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

KEN-MCD-6084b33e-1
0.516

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

MAR-TRE-6a44bbf2-36
0.515

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

MAK-UNK-7c9d1431-2
0.515

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

MAK-UNK-7c9d1431-22
0.500

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Nc1cc(-c2cc(S(=O)(=O)N3CCN(C(=O)CCl)CC3)ccc2F)cs1

MAK-UNK-c74072e5-9
0.500

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

LON-WEI-8f408cad-3
0.500

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

MAR-TRE-6a44bbf2-52
0.500

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

AAR-POS-d2a4d1df-22
0.500

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

MAK-UNK-7c9d1431-12
0.492

View
O=C(Nc1cccc(Cl)c1)Nc1cncc(CC(=O)N2CCN(S(=O)(=O)c3cccc(F)c3)CC2)c1

ABB-MCD-f549d731-1
0.488

View
O=C(CCl)N1CC2CC1CN2S(=O)(=O)c1cccc(F)c1

MAK-UNK-3f402c2b-2
0.485

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

BEN-DND-76ad4ac9-12
0.485

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

BEN-DND-76ad4ac9-10
0.478

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

SAD-SAT-3a925b8b-9
0.475

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

MAK-UNK-d4768348-1
0.475

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

MAK-UNK-d4768348-4
0.475

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

AAR-POS-0daf6b7e-15
0.475

View
CC(=O)N1CCN(C(C(=O)N2CCN(S(=O)(=O)c3cccc(F)c3)CC2)c2cccs2)CC1

MAK-UNK-902cc841-7
0.474

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

MAK-UNK-7c9d1431-30
0.471

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

MAR-TRE-6a44bbf2-45
0.471

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

SAD-SAT-3a925b8b-6
0.468

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

SAD-SAT-3a925b8b-3
0.468

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

MAK-UNK-d4768348-5
0.468

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

MAK-UNK-d4768348-8
0.468

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

NIM-UNI-05f93fcc-1
0.468

View
CC(=O)N1CCN(C(C(=O)N2CCN(S(=O)(=O)c3cccc(F)c3)CC2)c2ccsc2)CC1

MAK-UNK-902cc841-8
0.462

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

WAR-XCH-79d12f6e-6
0.462

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

MAR-TRE-6a44bbf2-13
0.462

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

AAR-POS-0daf6b7e-3
0.462

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

AAR-POS-d2a4d1df-36
0.462

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

MAK-UNK-d4768348-7
0.460

View
O=C(CN(C(=O)Nc1cccnc1)c1ccccc1)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1

KAY-MCD-59dc2eb3-1
0.460

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

BEN-DND-76ad4ac9-11
0.456

View
O=C(CCl)N1CCN(C(c2ccccc2)c2cccc(F)c2)CC1

GIA-UNK-7337c2f3-5
0.456

View
O=C(CCl)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1c1nccs1

MIK-MCD-8542a490-1
0.456

View
O=C(CN1CCN(C(=O)CCl)CC1)Nc1cccc(F)c1

MAR-TRE-6a44bbf2-3
0.449

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

AAR-POS-d2a4d1df-37
0.448

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

MAR-TRE-6a44bbf2-7
0.448

View
O=C(O)CCC(=O)N1CCN(S(=O)(=O)c2cc(F)cc(F)c2)CC1

ZAC-MCD-2bc172dc-1
0.446

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

MAR-TRE-6a44bbf2-28
0.444

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

MAK-UNK-7c9d1431-23
0.444

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

MAK-UNK-d4768348-2
0.444

View
O=C(CC1CN(c2ccccc2)C(=O)N1c1cccnc1)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1

ZAC-MCD-b48cf8fd-1
0.444

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

NIM-UNI-05f93fcc-2
0.443

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

MED-COV-4280ac29-5
0.442

View
C=CC(=O)N(C)CC(=O)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1

SAD-SAT-2ceae68f-1
0.440

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

MAK-UNK-d4768348-3
0.438

View
O=C(CCl)N1CCN(C(c2cccc(F)c2)c2cc(Cl)cc(Cl)c2)CC1

GIA-UNK-4de5abb1-4
0.437

View
O=C(CO)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.769

View
CCC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.755

View
CSCC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.727

View
CS(=O)(=O)CC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.714

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

0.709

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

0.709

View
CN(C)CC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.702

View
COCC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.702

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

0.702

View
CCS(=O)(=O)CC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.702

View
CC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.692

View
O=C(CN1C(=O)CCC1=O)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.683

View
O=C(CC1=CC=CC=C1F)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.683

View
O=C(CC1=CC(F)=CC=C1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.678

View
O=C(CN1CCCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.678

View
CCN(CC)CC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.678

View
CC(=O)OCC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.678

View
O=C(CC1=CC=CC=C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.667

View
NC(=O)CSCC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.667

View
O=C(CS(=O)(=O)C1CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.667

View
O=C(CC1=CC=C(Cl)C=C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.661

View
NC(=O)CN1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1

0.661

View
O=C(CC1=CC=CC=C1Cl)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.661

View
O=S(=O)(C1=CC(F)=CC=C1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.660

View
O=C(CS(=O)(=O)C1=CC=CC=C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.656

View
O=C(CN1CCCCCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.656

View
O=C(CN1C2CCC1CC2)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.656

View
CC(=O)CSCC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.656

View
O=C(CN1CCSSCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.651

View
O=C(CN1CCNCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.651

View
O=C(CN1CCS(=O)(=O)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.651

View
CC1CN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1C

0.651

View
O=C(CN1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC(F)=CC=C3)CC2)CC1)N1CCCC1

0.645

View
O=C(CN1CCCCCCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.645

View
O=C(CN(CCO)CCO)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.645

View
O=C(CN(C1CC1)C1CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.645

View
O=C(CN1C[C@H](O)[C@H](O)C1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.645

View
O=C(CN1CCS(=O)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.641

View
CCC(=O)N1CCCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.639

View
O=C(CN1CCCC1)N1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC(F)=CC=C3)CC2)CC1

0.635

View
NS(=O)(=O)N1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1

0.635

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

0.635

View
CC(=O)N1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1

0.635

View
CS(=O)(=O)N1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1

0.635

View
O=C(CSC1=CC(F)=CC=C1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.635

View
O=C(CSC1=CC=CC=C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.635

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

0.635

View
O=C(CC1=CC=CS1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.635

View
O=C(CC1CCCCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.635

View
CCCN(CCC)CC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.635

View
O=C(CN1CC2CC2C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.635

View
O=C(N1CCCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.632

View
O=C(COC1=C(Cl)C=CC=C1Cl)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.631

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

0.630

View
O=C(CN1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC(F)=CC=C3)CC2)CC1)N1CCCCC1

0.625

View
CN1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1

0.625

View
O=C(CO)N1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1

0.625

View
O=C(CNC1=CC(F)=CC=C1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.625

View
O=C(CN1CCOCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.625

View
O=C(CN1CCSCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.625

View
O=C(CN1CCC(F)(F)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.625

View
O=C(CN1CCC(F)CC1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.625

View
O=C(CN1CC2=CC=CC=C2C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.625

View
O=C(CSC1=CC=C(F)C=C1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.625

View
O=C(CNC1=CC(F)=CC(F)=C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.625

View
O=C(CN1CCN(CCO)CC1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.625

View
CN(CC(=O)N1CCCC1)CC(=O)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.625

View
O=C(C(=O)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1)N1CCCC1

0.621

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

0.615

View
O=C(COC1=CC=C(F)C=C1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.615

View
O=C(CN1CCC2(CC1)CC2)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.615

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

0.615

View
O=C(COC1=C(F)C=CC=C1F)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.615

View
O=C(CNC1=C(F)C=CC=C1F)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.615

View
O=C(CNC1=CC=CC=C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.615

View
O=C(CNC1=CC=C(F)C=C1)N1CCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.615

View
CC1(C)CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1

0.615

View
C=C1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC(F)=CC=C3)CC2)CC1

0.615

View
O=C(CN1CCC(C2CC2)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.615

View
O=C(COC1=CC=C(Cl)C=C1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.612

View
O=C(C1=C(Cl)C=CC=C1Cl)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.607

View
O=C(CN1CCCN(CC(=O)N2CCN(S(=O)(=O)C3=CC(F)=CC=C3)CC2)CC1)N1CCCC1

0.606

View
O=C(CSCC1=C(F)C=CC=C1F)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.606

View
O=C(CN1CCN(CC(F)(F)F)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.606

View
O=C(CN1CC=CCC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.606

View
O=C(CN1CCN(C(=O)N2CCCC2)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.597

View
O=C(CN1CCC2=CC=CC=C2CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.597

View
O=C(CN1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1)N1CCCC1

0.597

View
O=C(CN1CCOCC1)N1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC(F)=CC=C3)CC2)CC1

0.588

View
O=C(CC1=CC(F)=CC=C1)N1CCCN(S(=O)(=O)C2=CC=CC(F)=C2)CC1

0.582

View
O=C(CN1CCN(C(=O)C(=O)N2CCCC2)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.580

View
CN(C)CC(=O)N1CCN(CC(=O)N2CCN(S(=O)(=O)C3=CC=CC(F)=C3)CC2)CC1

0.580

View
O=C(CN1CCN(C(=O)N2CCCCC2)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.580

View
O=C(CN1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1)N1CCCCCC1

0.578

View
O=C(CN1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1)N1CCCCC1

0.578

View
O=C(CN1CCN(C2=CC(F)=CC(F)=C2)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.571

View
O=C(CN1CCN(C2=CC=CC=C2Cl)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.562

View
O=C(CC1=CC(F)=CC=C1)N1CCN(S(=O)(=O)C2=CC=CC(Cl)=C2)CC1

0.559

View
O=C(CN1CCN(C2=CC=CC=C2F)CC1)N1CCN(S(=O)(=O)C2=CC(F)=CC=C2)CC1

0.541

View
O=C(CC1=CC(F)=CC=C1)N1CCN(S(=O)(=O)C2=CC=CC=C2)CC1

0.522

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)CCl

1.000

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

0.714

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

0.692

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)CN1CCCC1

0.678

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

0.667

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)CN1CCCCC1

0.656

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)CC1CCCC1

0.656

View
Fc1ccc(cc1F)S(=O)(=O)N1CCN(CC1)C(=O)CCl

0.649

View
CNC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.643

View
Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)CCl

0.636

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

0.630

View
CC1CC1C(=O)N1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.627

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)C1CC1

0.621

View
CCNC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.617

View
CC1CCN(CC(=O)N2CCN(CC2)S(=O)(=O)c2cccc(F)c2)CC1

0.606

View
CC1CC(C)CN(CC(=O)N2CCN(CC2)S(=O)(=O)c2cccc(F)c2)C1

0.606

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)C1CCC1

0.600

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)CCCN1CCCCC1

0.597

View
CC1CCCCN1CC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.580

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

0.574

View
ClCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc2ccccc2c1

0.571

View
Fc1cccc(F)c1S(=O)(=O)N1CCN(CC1)C(=O)CCl

0.569

View
CC1CCCN(CC(=O)N2CCN(CC2)S(=O)(=O)c2cccc(F)c2)C1

0.563

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

0.562

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)C1CCCCC1

0.562

View
ClCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(Cl)cc1

0.561

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)C(=O)CN1CCN(CC(=O)NC2CC2)CC1

0.556

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

0.554

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

0.552

View
CCCCNC(=O)CN1CCN(CC(=O)N2CCN(CC2)S(=O)(=O)c2cccc(F)c2)CC1

0.547

View
Fc1cccc(c1)S(=O)(=O)N1CCNCC1

0.545

View
OCCCN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.541

View
Cl.Fc1cccc(c1)S(=O)(=O)N1CCNCC1

0.536

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CC=C)CC1

0.533

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

0.529

View
Fc1ccccc1S(=O)(=O)N1CCN(CC1)C(=O)CCl

0.525

View
Cl.CC(C)CN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.525

View
CCNC(=O)CN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.523

View
CCCCN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.516

View
Cl.CC(C)CCN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.516

View
CC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.515

View
Cl.CCCCN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.508

View
Fc1cccc(c1)S(=O)(=O)N1CCN(CCC#N)CC1

0.508

View
Cl.CCC(CC)CN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.508

View
Fc1cccc(c1)S(=O)(=O)NCCN1CCN(CC1)S(=O)(=O)c1cccc(F)c1

0.485

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

0.476

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

0.455

View
CCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(F)cc1

0.452

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

0.429

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

0.419

View
Fc1ccc(cc1F)S(=O)(=O)N1CCN(CC1)C(=O)CN1CCCCC1

0.417

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(F)cc1

0.393

View
CC(=O)N1CCN(CCNS(=O)(=O)c2cccc(F)c2)CC1

0.389

View
COc1ccc(cc1F)S(=O)(=O)N1CCN(CC1)C(C)=O

0.388

View
CC(Cl)C(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1

0.385

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

0.383

View
CSCC(=O)N1CCN(CC1)S(=O)(=O)c1cc(F)ccc1F

0.380

View
NC(=O)CN1CCN(CC1)S(=O)(=O)c1cc(F)cc(F)c1

0.369

View
Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)C=C

0.369

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

0.353

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1c(F)cccc1F

0.344

View
CC(=O)NCCNS(=O)(=O)c1cccc(F)c1

0.338

View
CCN1CCN(CC1)S(=O)(=O)c1ccc(F)c(F)c1

0.333

View
CN1CCN(CC1)S(=O)(=O)c1ccc(F)c(F)c1

0.333

View
CN1CCN(CC1)S(=O)(=O)c1cc(F)cc(F)c1

0.323

View
Fc1ccc(cc1F)S(=O)(=O)N1CCN(CC1)C=O

0.313

View
CC(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1F

0.313

View
Fc1cc(F)cc(c1)S(=O)(=O)N1CCN(CC(=O)NC2CC2)CC1

0.307

View
Fc1cc(F)cc(c1)S(=O)(=O)N1CCN(CC(=O)NCC=C)CC1

0.303

View
CC(=O)N1CCN(CCNS(=O)(=O)c2cc(F)cc(F)c2)CC1

0.270

View
Cl.CCN1CCN(CC1)S(=O)(=O)c1cc(F)ccc1F

0.264

View
CC(=O)N1CCN(CCNS(=O)(=O)c2cc(F)ccc2F)CC1

0.253

View
CC(=O)N1CCN(CCNS(=O)(=O)c2ccc(F)c(F)c2)CC1

0.237

View
CN(C)CCN(CCN(C)C)S(=O)(=O)c1cc(F)cc(F)c1

0.176

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

0.955

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

0.953

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

0.919

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

0.912

View
C(N1CCN(S(=O)(C2=CC=CC(F)=C2)=O)CC1)(=O)CSC

0.908

View

Discussion: