Molecular Properties | |
SMILES: | NS(=O)(=O)c1cccc(-n2cc(CN3CC4CC3CN4C(=O)CCl)nn2)c1 |
MW: | 410.09 |
Fraction sp3: | 0.44 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 114.42 |
cLogP: | -0.06 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Dye 22
MED-COV-4280ac29-15
NIM-UNI-bb610069-3
0.591
NIM-UNI-594fbbb6-3
0.591
MAK-UNK-ec98eaf6-57
0.584
NIM-UNI-02269248-3
0.534
MAK-UNK-bae89c02-3
0.479
DAR-DIA-3e9bbd81-4
0.464
SAD-SAT-581007d4-10
0.451
DAR-DIA-3e9bbd81-8
0.446
DAR-DIA-3e9bbd81-10
0.434
DAR-DIA-3e9bbd81-9
0.431
DAN-LON-a5fc619e-8
0.420
MAK-UNK-3f402c2b-3
0.416
MAK-UNK-bae89c02-4
0.415
MAK-UNK-3f402c2b-22
0.414
MAK-UNK-10799360-6
0.412
MAK-UNK-df1a028e-8
0.407
MAK-UNK-df1a028e-1
0.407
MAK-UNK-3f402c2b-26
0.393
MAK-UNK-10799360-4
0.390
MAK-UNK-3f402c2b-21
0.389
MAK-UNK-df1a028e-6
0.389
MAK-UNK-10799360-17
0.382
MAK-UNK-10799360-30
0.380
MAK-UNK-3f402c2b-14
0.379
MAK-UNK-3f402c2b-16
0.378
MAK-UNK-3f402c2b-2
0.372
MAK-UNK-ec98eaf6-17
0.370
ANT-STE-dbb91f63-2
0.366
SAD-SAT-581007d4-9
0.366
MAK-UNK-10799360-21
0.365
MAK-UNK-ec98eaf6-11
0.363
MAK-UNK-ec98eaf6-14
0.361
DAR-DIA-3e9bbd81-1
0.360
MAK-UNK-ec98eaf6-10
0.359
DAR-DIA-3e9bbd81-2
0.359
MAK-UNK-ec98eaf6-2
0.359
MAK-UNK-ec98eaf6-21
0.359
MAK-UNK-10799360-16
0.356
MAK-UNK-ec98eaf6-22
0.353
MAK-UNK-5d2caa6f-6
0.353
MAK-UNK-5d2caa6f-7
0.353
MAK-UNK-ec98eaf6-16
0.353
MAK-UNK-ec98eaf6-7
0.352
PEI-IMP-e4a008a2-1
0.352
MAK-UNK-ec98eaf6-24
0.350
MAK-UNK-10799360-22
0.350
MAK-UNK-10799360-10
0.348
MAK-UNK-ec98eaf6-23
0.346
MAK-UNK-10799360-20
0.346
MAK-UNK-ec98eaf6-47
0.345
MAK-UNK-10799360-19
0.339
MAK-UNK-3f402c2b-5
0.333
MAK-UNK-10799360-32
0.333
MAK-UNK-3f402c2b-9
0.330
MAK-UNK-3f402c2b-17
0.327
MAK-UNK-3f402c2b-29
0.325
MAK-UNK-ec98eaf6-19
0.324
MAK-UNK-ec98eaf6-20
0.324
MAK-UNK-3f402c2b-15
0.323
MAK-UNK-ec98eaf6-35
0.321
JOH-UNK-14e6adc5-8
0.320
MAK-UNK-3f402c2b-11
0.320
MAK-UNK-ec98eaf6-13
0.320
MAK-UNK-3e0761f8-10
0.317
MAK-UNK-3f402c2b-12
0.316
MAK-UNK-10799360-12
0.316
MAK-UNK-10799360-5
0.314
MAK-UNK-10799360-8
0.314
MAK-UNK-3f402c2b-1
0.312
MAK-UNK-3f402c2b-24
0.312
MAK-UNK-5d2caa6f-23
0.310
MAK-UNK-ec98eaf6-36
0.308
MAK-UNK-3f402c2b-13
0.307
MAK-UNK-10799360-36
0.306
MAK-UNK-ec98eaf6-25
0.305
MAK-UNK-90d0606b-1
0.305
MAK-UNK-ec98eaf6-4
0.303
MAK-UNK-ec98eaf6-28
0.302
MAK-UNK-3f402c2b-25
0.301
AHN-SAT-721e3e40-1
0.301
MAK-UNK-10799360-23
0.301
MAK-UNK-3e0761f8-4
0.299
MAK-UNK-90d0606b-7
0.298
MAK-UNK-3f402c2b-27
0.298
MAK-UNK-10799360-28
0.296
TOB-UNK-c2aba166-5
0.296
MAK-UNK-10799360-26
0.294
SAD-SAT-c989feaa-9
0.294
MAK-UNK-ec98eaf6-49
0.294
MAK-UNK-10799360-14
0.293
MAK-UNK-90d0606b-3
0.291
ANT-STE-dbb91f63-1
0.291
MAK-UNK-3f402c2b-7
0.290
SAD-SAT-3a925b8b-8
0.289
MAK-UNK-ec98eaf6-3
0.288
MAK-UNK-ec98eaf6-50
0.288
MAK-UNK-3f402c2b-6
0.286
MAK-UNK-10799360-35
0.286
MAK-UNK-ec98eaf6-6
0.286
DAR-DIA-3e9bbd81-3
0.286