Molecule Details

Molecular Properties
SMILES:
CS(=O)(=O)NCCN1CCCc2ccc(S(N)(=O)=O)cc21
MW: 333.435
Fraction sp3: 0.5
HBA: 5
HBD: 2
Rotatable Bonds: 5
TPSA: 109.57
cLogP: -0.364199999999998
Covalent Warhead:
Covalent Fragment: ✔️
Source
Enamine SCR: Z1317949519
Enamine REAL: Z1317949519
Enamine Extended REAL: s_2230____7463156____4117666
Activity Data
Average Inhibition @ 20 µM - Fluorescence: 4.677893
Average Inhibition @ 50 µM - Fluorescence: -5.456835
Relative Solubility @ 20 µM: 1.0
Relative Solubility @ 100 µM: 1.0
Order Status
Ordered: 2020-03-31
Synthesis Location: enamine
Shipped: 2020-05-20

Dye 22

Hetero_hetero

CS(=O)(=O)NCCCN1CCCc2ccc(S(N)(=O)=O)cc21

PET-SGC-abcbce68-1
0.790

View
NCCN1CCCc2ccc(S(N)(=O)=O)cc21

MAK-UNK-0b1cbb06-3
0.700

View
NS(=O)(=O)c1ccc2c(c1)N(CCNC(=O)N1CCCCC1)CCC2

PET-SGC-616b7348-1
0.608

View
NCN1CCCc2ccc(S(N)(=O)=O)cc21

MAK-UNK-0b1cbb06-4
0.607

View
N=C(N)CCCCN1CCCc2ccc(S(N)(=O)=O)cc21

PET-SGC-6a1b02a9-1
0.594

View
NS(=O)(=O)c1ccc2c(c1)N(CCN1CCC(O)CC1)CCC2

PET-SGC-908c18f3-1
0.554

View
Cc1nnc(CCN2CCCc3ccc(S(N)(=O)=O)cc32)s1

PET-SGC-c4a91520-1
0.553

View
NS(=O)(=O)c1ccc2c(c1)N(CCCN1CCN(C(=O)CCl)CC1)CCC2

PAU-UNI-2d648ace-1
0.537

View
NS(=O)(=O)c1ccc2c(c1)N(CCNC(=O)Nc1cccnc1)CCC2

PET-SGC-59809fea-1
0.529

View
CN1CCCc2ccc(S(N)(=O)=O)cc21

AAR-POS-d2a4d1df-4
0.516

View
CC(CNCCCO)CN1CCCc2ccc(S(N)(=O)=O)cc21

MAK-UNK-0b1cbb06-2
0.500

View
Cc1nnc(CN2CCCc3ccc(S(N)(=O)=O)cc32)s1

NAU-LAT-42d4957e-4
0.500

View
Cc1ccc(OCC(=O)CCN2CCCc3ccc(S(N)(=O)=O)cc32)cc1

NAU-LAT-42d4957e-2
0.500

View
Cc1ccncc1NC(=O)CCN1CCCc2ccc(S(N)(=O)=O)cc21

PET-SGC-05cff2e1-1
0.494

View
NS(=O)(=O)c1ccc2c(c1)N(CCCN1CC3CC1CN3C(=O)CCl)CCC2

MAK-UNK-10799360-30
0.477

View
NS(=O)(=O)c1ccc2c(c1)N(CCNC(=O)Cc1c[nH]c3ncccc13)CCC2

PET-SGC-fc67af9f-1
0.474

View
NS(=O)(=O)c1ccc2c(c1)N(CCC(=O)c1c[nH]c3ncccc13)CCC2

NAU-LAT-42d4957e-5
0.467

View
NS(=O)(=O)c1ccc2c(c1)N(CCCCC1CCCN(C(=O)CCl)C1)CCC2

PAU-UNI-f4334617-1
0.467

View
NS(=O)(=O)c1ccc2c(c1)N(CCCCC1CC3CC1N(C(=O)CCl)C3)CCC2

MAK-UNK-10799360-15
0.462

View
NS(=O)(=O)c1ccc2c(c1)N(CC(=O)Nc1cccnc1)CCC2

TAM-UNI-c140e31a-6
0.447

View
Cc1cc(CN(CCCCN2CCCc3ccc(S(N)(=O)=O)cc32)C(=O)NC2CC2)no1

PET-SGC-210d4c30-1
0.439

View
NS(=O)(=O)c1ccc2c(c1)N(CCC(CNC(=O)NC1CCCCC1)c1ccncc1)CCC2

PET-SGC-f913cec9-1
0.424

View
NS(=O)(=O)c1ccc2c(c1)N(CCC(Cc1ccncc1)NC(=O)NC1CCCCC1)CCC2

PET-SGC-f913cec9-2
0.412

View
CC1CC=NCC1NC(=O)COCN1CCCc2ccc(S(N)(=O)=O)cc21

WIL-WAB-1289c0dd-2
0.411

View
NC(=O)[C@H]1CCCC1N1CCCc2ccc(S(N)(=O)=O)cc21

PET-SGC-481b48b7-1
0.383

View
NS(=O)(=O)c1ccc2c(c1)N(C(=O)N1CCC(O)CC1)CCC2

NAU-LAT-42d4957e-3
0.383

View
Cc1cc(CN(CCCN(C)CN2CCCc3ccc(S(N)(=O)=O)cc32)C(=O)NC2CC2)no1

DAR-DIA-37454fd7-1
0.382

View
NS(=O)(=O)c1ccc2c(c1)N(CC(=O)N1Cc3ccccc3C(c3ccccc3)C1)CCC2

JAR-IMP-ed466bb3-6
0.374

View
CNCc1cc(-c2ccccc2CN2CCCc3ccc(S(N)(=O)=O)cc32)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-9a6be56d-2
0.373

View
Cc1cc(CN(C(=O)NC2CC2)C2CCC(CN3CCCc4ccc(S(N)(=O)=O)cc43)CC2)no1

DAR-DIA-37454fd7-2
0.371

View
C/C=C(\C=C\CN(Cc1cc(C)on1)C(=O)NC1CC1)CN1CCCc2ccc(S(N)(=O)=O)cc21

DAR-DIA-37454fd7-3
0.358

View
CC(=O)N1CCN(CC2CCc3ccc(S(N)(=O)=O)cc3N2C)CC1

HEI-REL-0c990a45-1
0.357

View
CS(=O)(=O)NCCn1ccc2cc(S(N)(=O)=O)ccc21

SIM-DEM-5935bd74-7
0.355

View
CN1CCCc2ccc(S(=O)(=O)NCN3CCOCC3)cc21

MAK-UNK-0b1cbb06-1
0.353

View
NS(=O)(=O)c1ccc2c(c1)N(CNCc1cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c1)CCC2

MAK-UNK-9a6be56d-1
0.351

View
CN1c2cc(S(N)(=O)=O)ccc2CCC1CN1CCN(C(=O)CCl)CC1

JOK-SYG-6ec557d2-1
0.348

View
CC(NC(=O)CCl)C1CCc2ccc(S(N)(=O)=O)cc2N1C

JOK-SYG-ac99ed27-1
0.345

View
CN1CC(CO)Cc2ccc(S(N)(=O)=O)cc21

MAK-UNK-0b1cbb06-5
0.338

View
CN1c2cc(S(N)(=O)=O)ccc2CCC1C(=O)N1CCN(C(=O)CCl)CC1

HAR-NEW-e34cb1ae-5
0.333

View
NS(=O)(=O)c1ccc2c(c1)N(C(=O)Cc1c[nH]c3ncccc13)CCC2

TAM-UNI-c140e31a-4
0.327

View
C=CC1=CC=CS1(N)C1CCc2ccc(S(N)(=O)=O)cc2N1C

ASH-SAT-43770c7d-2
0.326

View
CN1c2cc(S(N)(=O)=O)ccc2CCC1C(=O)N1CCC(O)CC1

HAR-NEW-e34cb1ae-6
0.326

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cnccc2N2CCCc3ccc(S(N)(=O)=O)cc32)c1

MAK-UNK-9a6be56d-15
0.313

View
NS(=O)(=O)c1ccc2c(c1)CCCN2CC(=O)Nc1cccnc1

TAM-UNI-c140e31a-12
0.312

View
CN1CCOc2ccc(S(N)(=O)=O)cc21

IND-SYN-8f867502-2
0.311

View
CS(=O)(=O)NCCc1ccc2cc(S(N)(=O)=O)ccc2c1

SIM-DEM-5935bd74-2
0.308

View
CN1CC[Si](C)(C)c2ccc(S(N)(=O)=O)cc21

IND-SYN-8f867502-3
0.307

View
CN1CC[Si](C)(C)c2ccc(S(N)(=O)=O)cc21

IND-SYN-058869ff-1
0.307

View
CS(=O)(=O)NCCc1ccc2ccc(S(N)(=O)=O)cc2c1

PET-SGC-85e821e4-1
0.304

View
CN1CCS(=O)(=O)c2ccc(S(N)(=O)=O)cc21

IND-SYN-8f867502-1
0.303

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccc(N3CCCc4ccc(S(N)(=O)=O)cc43)c2)c1

MAK-UNK-9a6be56d-18
0.301

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2N2CCCc3ccc(S(N)(=O)=O)cc32)c1

MAK-UNK-9a6be56d-19
0.299

View
CNCc1cc(-c2c(F)cccc2N2CCCc3ccc(S(N)(=O)=O)cc32)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-9a6be56d-24
0.298

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2ccc(N3CCCc4ccc(S(N)(=O)=O)cc43)nc2)c1

MAK-UNK-9a6be56d-17
0.296

View
CC(=O)N1CCC(CN2CCc3ccc(S(N)(=O)=O)cc3C2=O)CC1

HEI-REL-0c990a45-3
0.295

View
NS(=O)(=O)c1ccc2c(c1)N(C(=O)Cc1c[nH]c3ncccc13)CCCC2

TAM-UNI-c140e31a-17
0.294

View
CS(=O)(=O)NCCN1CCCC2C=C(S(N)(=O)=O)C=CC21

SIM-DEM-5935bd74-5
0.294

View
CNCc1cc(-c2ccc(N3CCCc4ccc(S(N)(=O)=O)cc43)cc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-9a6be56d-22
0.293

View
CNCC1=CC(N2CCCc3ccc(S(N)(=O)=O)cc32)(S(=O)(=O)c2cccnc2)C(c2ccccc2F)=C1

MAK-UNK-9a6be56d-11
0.293

View
CNCc1cc(-c2cc(N3CCCc4ccc(S(N)(=O)=O)cc43)ccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-9a6be56d-23
0.293

View
CS(=O)(=O)NCCc1cccc2cc(S(N)(=O)=O)ccc12

PET-SGC-85e821e4-2
0.293

View
CS(=O)(=O)NCCc1cccc2cc(S(N)(=O)=O)ccc12

SIM-DEM-5935bd74-1
0.293

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=CN2CCCc3ccc(S(N)(=O)=O)cc32)c2cccnc2)c1

MAK-UNK-9a6be56d-14
0.291

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cncc(N3CCCc4ccc(S(N)(=O)=O)cc43)c2)c1

MAK-UNK-9a6be56d-16
0.291

View
CNCc1cc(-c2cccc(N3CCCc4ccc(S(N)(=O)=O)cc43)c2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-9a6be56d-21
0.288

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1N1CCCc2ccc(S(N)(=O)=O)cc21

MAK-UNK-9a6be56d-12
0.287

View
CNCc1cn(S(=O)(=O)c2cccnc2)c(-c2ccccc2F)c1N1CCCc2ccc(S(N)(=O)=O)cc21

MAK-UNK-9a6be56d-10
0.287

View
CC(=O)N1CCN(CC2CCc3ccc(S(N)(=O)=O)cc3N2)CC1

HEI-REL-0c990a45-2
0.284

View
CC(=O)N1Cc2ccccc2C(C2CCc3ccc(S(N)(=O)=O)cc3N2C)C1

HEI-REL-0c990a45-6
0.283

View
NS(=O)(=O)c1ccc2c(c1)CCCCN2CC(=O)Nc1cccnc1

TAM-UNI-c140e31a-14
0.281

View
CN1c2cc(S(N)(=O)=O)ccc2CC[C@@H]1c1ccn(C[C@@H]2CCOC2)n1

STE-NAN-bafe64f0-1
0.280

View
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCl

MAR-TRE-6a44bbf2-33
0.278

View
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCl

SAD-SAT-5b1897b2-7
0.278

View
CNC(c1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)N1CCCc2ccc(S(N)(=O)=O)cc21

MAK-UNK-9a6be56d-9
0.274

View
COc1[o+]cc(CCNS(C)(=O)=O)c2cc(S(N)(=O)=O)ccc12

ASH-UNK-40b46b30-6
0.273

View
CC(Cc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)N1CCCc2ccc(S(N)(=O)=O)cc21

MAK-UNK-9a6be56d-8
0.271

View
Cc1ccncc1NC(=O)CCN1CC(C#N)Cc2ccc(S(N)(=O)=O)cc21

HAR-NEW-e34cb1ae-4
0.271

View
CS(=O)(=O)NCCc1cccc(CC(=N)N)c1

MAK-UNK-27459e11-10
0.269

View
CS(=O)(=O)N(C[C@H]1CCN2c3cc(S(N)(=O)=O)ccc3CC[C@@H]2C1)C1=CCC([C@H](O)N2CCSCC2)=C1NC(=O)CCl

STE-NAN-bafe64f0-3
0.268

View
CCC(=O)NC(N)c1ccc2c(c1)N(C)CCC2

MAK-UNK-53da93bf-3
0.267

View
NS(=O)(=O)c1ccc2c(c1)CN(CC(=O)Nc1cccnc1)CCC2

TAM-UNI-c140e31a-1
0.263

View
CS(=O)(=O)NC[C@@H](C(=O)N1CCCc2ccncc21)c1ccc(F)cc1

DAN-RED-da448e80-7
0.260

View
CN1CCCc2ccc(C(N)CCN)cc21

MAK-UNK-53da93bf-2
0.259

View
CS(=O)(=O)NCCc1cccc(O)c1

ANT-DIA-b7f58f21-2
0.257

View
C=CC(=O)c1ccncc1NC(=O)CCN1CC(C#N)Cc2ccc(S(N)(=O)=O)cc21

HAR-NEW-e34cb1ae-3
0.254

View
NS(=O)(=O)c1ccc2c(c1)CN(CC1CCN(C(=O)CCl)CC1)CC2

STU-CHA-83dacf15-1
0.253

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=NS(=O)(=O)c2ccc3c(c2)N(C)CCC3)c2cccnc2)c1

MAK-UNK-9a6be56d-5
0.250

View
C=CC(=O)N1CCC(CN2CCc3ccc(S(N)(=O)=O)cc3C2)CC1

STU-CHA-83dacf15-2
0.250

View
NS(=O)(=O)c1ccc2c(c1)CCN(CC(=O)Nc1cccnc1)C2

TAM-UNI-c140e31a-13
0.250

View
CNCc1cc(-c2ccccc2NS(=O)(=O)c2ccc3c(c2)N(C)CCC3)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-9a6be56d-6
0.248

View
NS(=O)(=O)c1ccc2c(c1)CN(C(=O)Cc1c[nH]c3ncccc13)CCC2

TAM-UNI-c140e31a-8
0.248

View
CS(=O)(=O)NC[C@@H](C(=O)N1CCCc2ccncc21)c1ccc(Cl)cc1

DAN-RED-da448e80-11
0.248

View
CC(=O)N1CCN(CCCc2ccc(S(N)(=O)=O)cc2)CC1

WIL-LEE-23e8b574-7
0.244

View
NS(=O)(=O)c1ccc2c(c1)CN(CC(=O)NCc1c[nH]c3ncccc13)CCC2

TAM-UNI-c140e31a-9
0.243

View
CN1CCCc2ccc(S(=O)(=O)C(=O)N3Cc4ccccc4C(c4ccccc4)C3)cc21

JAR-IMP-ed466bb3-1
0.243

View
COc1ccc([C@@H](CNS(C)(=O)=O)C(=O)N2CCCc3ccncc32)cc1

DAN-RED-da448e80-15
0.243

View
N#CCC(=O)N1CCC(CN2CCc3ccc(S(N)(=O)=O)cc3C2)CC1

STU-CHA-83dacf15-3
0.242

View
CN(C)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)CCl

MAR-TRE-6a44bbf2-46
0.241

View
CS(=O)(=O)NCCc1cccc(C(=N)N)c1

MAK-UNK-27459e11-15
0.241

View
CC(C)NC1CCN(c2ccc(S(N)(=O)=O)cc2)CC1

WAR-XCH-b6889685-23
0.241

View
CS(=O)(=O)NCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

1.000

View
CS(=O)(=O)NCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.790

View
CCS(=O)(=O)NCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.778

View
CS(=O)(=O)NCCN1CCCC2=CC=C(S(C)(=O)=O)C=C21

0.770

View
CS(=O)(=O)NCCN1CCC2=CC=C(S(N)(=O)=O)C=C21

0.754

View
CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.689

View
NS(=O)(=O)C1=CC=C2CCCN(CCNS(=O)(=O)C3=CC=CC=C3)C2=C1

0.686

View
CCS(=O)(=O)NCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.682

View
CN1C=C(S(=O)(=O)NCCN2CCCC3=CC=C(S(N)(=O)=O)C=C32)C=N1

0.681

View
CNCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.677

View
COCCCS(=O)(=O)NCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.671

View
CS(=O)(=O)NCCN1CCCC2=CC=C(N)C=C21

0.662

View
NS(=O)(=O)C1=CC=C2CCCN(CCO)C2=C1

0.661

View
NS(=O)(=O)C1=CC=C2CCCN(CCI)C2=C1

0.661

View
CCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.656

View
CC(C)(C)CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.656

View
CS(=O)(=O)CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.652

View
CC1=CC=C2CCCN(CCNS(C)(=O)=O)C2=C1

0.646

View
COCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.646

View
CC(C)CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.646

View
NCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.641

View
CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.639

View
CC(C)NC(=O)NCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.639

View
CS(=O)(=O)NCCN1CCCC2=CC=C(F)C=C21

0.636

View
CS(=O)(=O)NCCN1CCCC2=CC=C(Br)C=C21

0.636

View
CCCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.636

View
CC(C)(O)CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.636

View
CS(=O)(=O)CCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.632

View
CN(CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21)S(C)(=O)=O

0.632

View
CCCS(=O)(=O)CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.632

View
NS(=O)(=O)C1=CC=C2CCCN(CCCO)C2=C1

0.631

View
NS(=O)(=O)CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.631

View
NS(=O)(=O)C1=CC=C2CCCN(CCC(F)(F)F)C2=C1

0.631

View
C=CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.631

View
C=C(C)CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.627

View
CC(C)(C)CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.627

View
CC(C)CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.627

View
COCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.627

View
CC(F)CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.627

View
NS(=O)(=O)C1=CC=C2CCCN(CCNC(=O)C3CC3)C2=C1

0.625

View
C#CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.621

View
NS(=O)(=O)C1=CC=C2CCCN(CCC3CC3)C2=C1

0.621

View
CC(C)(C)OCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CCCCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CCOCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CCSCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CCC(C)(C)CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CC#CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CSCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CC(C)(C)SCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CC(C)=CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
COC(C)(C)CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.618

View
CS(=O)(=O)NCCCN1CCC2=CC=C(S(N)(=O)=O)C=C21

0.612

View
NS(=O)(=O)C1=CC=C2CCCN(CCN3CCCC3=O)C2=C1

0.612

View
NS(=O)(=O)C1=CC=C2CCCN(CCCCF)C2=C1

0.612

View
CCS(=O)(=O)NCCN1CCCC2=CC=C(S(C)(=O)=O)C=C21

0.609

View
CC(C)OCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.609

View
CCCOCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.609

View
CC(C)SCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.609

View
CS(=O)(=O)NCCCN1CCCC2=CC=C(S(C)(=O)=O)C=C21

0.603

View
NS(=O)(=O)C1=CC=C2CCCN(CCCC(F)(F)F)C2=C1

0.603

View
NS(=O)(=O)C1=CC=C2CCCN(CCN3C(=O)CCC3=O)C2=C1

0.603

View
CCC=CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.600

View
CC(C)(C)OCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.600

View
CC(CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21)C(F)F

0.600

View
COCCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.600

View
CC(C)(C)S(=O)(=O)CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.600

View
NS(=O)(=O)C1=CC=C2CCCN(CCSC(F)(F)F)C2=C1

0.594

View
NS(=O)(=O)C1=CC=C2CCCN(CCCN3CCCC3=O)C2=C1

0.594

View
NCCCCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.594

View
CN(C)S(=O)(=O)CCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.592

View
CCC1=CC=C(CCN2CCCC3=CC=C(S(N)(=O)=O)C=C32)C=C1

0.592

View
NS(=O)(=O)C1=CC=C2CCCN(CCCCC(F)(F)F)C2=C1

0.586

View
NCCCCCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.586

View
NS(=O)(=O)C1=CC=C2CCCN(CCCCCCO)C2=C1

0.586

View
COCCOCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.583

View
CC1=CC=C(CCN2CCCC3=CC=C(S(N)(=O)=O)C=C32)C=C1

0.583

View
CS(=O)(=O)C1=CC=C(OCCN2CCCC3=CC=C(S(N)(=O)=O)C=C32)C=C1

0.581

View
CCS(=O)(=O)NCCN1CCC2=CC=C(S(N)(=O)=O)C=C21

0.580

View
NS(=O)(=O)C1=CC=C2CCCN(CCCCCCCO)C2=C1

0.577

View
CC(C)CN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.576

View
C[Si](C)(C)CN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.576

View
CC(N)CN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.576

View
CCOCCOCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.575

View
CC(C)(C)OCCCCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.575

View
CS(=O)(=O)C1=CC=C(OCCCN2CCCC3=CC=C(S(N)(=O)=O)C=C32)C=C1

0.573

View
NS(=O)(=O)C1=CC=C2CCCN(CCS(=O)(=O)C3=CC=CC=C3)C2=C1

0.569

View
NS(=O)(=O)C1=CC=C(OCCN2CCCC3=CC=C(S(N)(=O)=O)C=C32)C=C1

0.562

View
CS(=O)(=O)C1=CC=C2CCCN(CCNS(=O)(=O)C3=CC=CC=C3)C2=C1

0.553

View
CC1=CSC(=O)N1CCN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.553

View
CS(=O)(=O)NCCN1CCCC2=CC=CC=C21

0.552

View
CC1=CC=C2CCCCN(CCNS(C)(=O)=O)C2=C1

0.543

View
CCC(C)CN1CCCC2=CC=C(S(N)(=O)=O)C=C21

0.543

View
CS(=O)(=O)NCCN1CCC2=CC(S(N)(=O)=O)=CC=C21

0.536

View
CNS(=O)(=O)C1=CC=C2CCN(CCNS(C)(=O)=O)C2=C1

0.535

View
CN(C)S(=O)(=O)C1=CC=C2CCN(CCNS(C)(=O)=O)C2=C1

0.535

View
CS(=O)(=O)NCCN1CCC2=CC=C(S(=O)(=O)N3CCCC3)C=C21

0.527

View
NS(=O)(=O)C1=CC=C2CCN(CCNS(=O)(=O)C3=CC=CC=C3)C2=C1

0.513

View
CS(=O)(=O)NCCCN1CCCC2=CC=C(F)C=C21

0.493

View
NS(=O)(=O)C1=CC=C(S(=O)(=O)NCCN2CCCC3=CC=CC=C32)C=C1

0.456

View
CN1CCCc2ccc(cc12)S(N)(=O)=O

0.516

View
Cl.CN1CCCc2ccc(cc12)S(=O)(=O)NCCN

0.397

View
N1(CCNS(C)(=O)=O)CCCC2=C1C=CC=C2

0.552

View
N(S(=O)(=O)C1C=CC(N(=O)=O)=CC=1)CCN1C2=C(C=CC=C2)CCC1

0.372

View
N(S(=O)(=O)C1C=CC(C)=CC=1C)CCN1C2=C(C=CC=C2)CCC1

0.368

View
N(S(=O)(=O)C1C=CC(C(C)=O)=CC=1)CCCN1C2=C(C=CC=C2)CCC1

0.364

View
N(S(=O)(=O)C1C=CC(N=N#N)=CC=1)CCN1C2=C(C=CC=C2)CCC1

0.356

View
N(S(=O)(=O)C1=CC=C(F)C(N(=O)=O)=C1)CCN1C2=C(C=CC=C2)CCC1

0.355

View
N(S(=O)(=O)C1=CC=C(C)C(C)=C1)CCCN1C2=C(C=CC=C2)CCC1

0.352

View
N(S(=O)(=O)C1C=CC(C)=CC=1)CCCN1C2=C(C=CC=C2)CCC1

0.349

View
N(S(=O)(=O)C1C=CC(CC)=CC=1)CCCN1C2=C(C=CC=C2)CCC1

0.345

View
N(S(=O)(=O)C1C=CC(C(C)C)=CC=1)CCCN1C2=C(C=CC=C2)CCC1

0.341

View
N(S(=O)(=O)C1=CC=CC(C)=C1)CCCN1C2=C(C=CC=C2)CCC1

0.337

View
N(S(=O)(=O)C1=CC=CC=C1)CCCN1C2=C(C=CC=C2)CCC1

0.333

View
N(S(=O)(=O)C1C=CC(CCC)=CC=1)CCCN1C2=C(C=CC=C2)CCC1

0.330

View
N(S(=O)(=O)C1C=CC(C#N)=CC=1)CCCN1C2=C(C=CC=C2)CCC1

0.322

View
C(NCCN1C2=C(C=CC=C2)CCC1)(=O)CNS(C1C=CC=C(C)C=1)(=O)=O

0.316

View
N(S(=O)(=O)C1C=C2CCCN(C(C)=O)C2=CC=1)CCN(C)C

0.264

View
N(S(=O)(=O)C1C=C2CCCN(C(C)=O)C2=CC=1)CCN(CC)CC

0.255

View
C(N1C2=C(C=CC=C2)CCC1)(=O)CNS(C1C=CC=C(C)C=1)(=O)=O

0.237

View
C(N1C2=C(C=CC=C2)CCC1)(=O)CNS(C1=CC=C(Cl)C=C1)(=O)=O

0.232

View
C(N1C2=C(C=CC=C2)CCC1)(=O)CNS(C1=CC=C(F)C=C1)(=O)=O

0.232

View


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