Molecular Properties | |
SMILES: | Cc1cc2c(cc1S(N)(=O)=O)CN(CC1CC3CC1CN3C(=O)CCl)CC2 |
MW: | 411.14 |
Fraction sp3: | 0.63 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 83.71 |
cLogP: | 1.48 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
MED-COV-4280ac29-15
MAK-UNK-10799360-9
0.718
MAK-UNK-90d0606b-6
0.667
STU-CHA-09bcc2f6-1
0.563
MAK-UNK-10799360-11
0.444
MAK-UNK-ec98eaf6-38
0.389
MAK-UNK-ec98eaf6-35
0.384
STU-CHA-814c6126-1
0.376
MAK-UNK-3e0761f8-6
0.353
MAK-UNK-ec98eaf6-48
0.350
STU-CHA-83dacf15-1
0.350
MAK-UNK-ec98eaf6-37
0.343
MAK-UNK-df1a028e-5
0.340
MAK-UNK-ec98eaf6-33
0.336
MAK-UNK-3f402c2b-12
0.326
MAK-UNK-ec98eaf6-32
0.323
MAK-UNK-ec98eaf6-43
0.319
MAK-UNK-ec98eaf6-36
0.317
MAK-UNK-10799360-16
0.314
MAK-UNK-3f402c2b-17
0.309
MAK-UNK-3e0761f8-8
0.309
MAK-UNK-5d2caa6f-20
0.309
MAK-UNK-3e0761f8-5
0.307
MAK-UNK-10799360-34
0.305
MAK-UNK-90d0606b-2
0.303
STU-CHA-83dacf15-2
0.295
MAK-UNK-90d0606b-8
0.294
MAK-UNK-5d2caa6f-21
0.293
MAK-UNK-3e0761f8-3
0.291
MAK-UNK-3f402c2b-28
0.289
MAK-UNK-3f402c2b-19
0.289
STU-CHA-83dacf15-3
0.287
MAK-UNK-3f402c2b-20
0.286
MAK-UNK-3e0761f8-1
0.286
MAK-UNK-10799360-15
0.284
MAK-UNK-3f402c2b-18
0.284
DAV-CRI-3fe943ba-1
0.282
MAK-UNK-90d0606b-9
0.282
MAK-UNK-3f402c2b-3
0.281
MAK-UNK-5d2caa6f-16
0.278
TAM-UNI-d1c3dd9f-8
0.277
MAK-UNK-3f402c2b-5
0.274
MAK-UNK-10799360-3
0.274
MAK-UNK-3f402c2b-4
0.272
MAK-UNK-3f402c2b-29
0.272
MAK-UNK-ec98eaf6-5
0.269
DAV-CRI-3fe943ba-2
0.268
TAM-UNI-d1c3dd9f-10
0.268
MAK-UNK-5d2caa6f-1
0.267
MAK-UNK-90d0606b-10
0.267
SAD-SAT-581007d4-10
0.265
MAK-UNK-3f402c2b-13
0.265
DAR-DIA-3e9bbd81-4
0.264
RHE-UNK-eb059eb9-1
0.263
MAR-TRE-6a44bbf2-13
0.263
AAR-POS-0daf6b7e-3
0.263
AAR-POS-d2a4d1df-36
0.263
WAR-XCH-79d12f6e-6
0.263
PEI-IMP-e4a008a2-1
0.263
DAR-DIA-caba39e3-10
0.263
MAK-UNK-3f402c2b-11
0.263
MAK-UNK-3e0761f8-4
0.259
MAK-UNK-5d2caa6f-19
0.259
MAK-UNK-10799360-30
0.259
SAD-SAT-5b1897b2-7
0.258
MAR-TRE-6a44bbf2-33
0.258
SAD-SAT-3a925b8b-8
0.258
TAM-UNI-d1c3dd9f-5
0.257
MAK-UNK-5d2caa6f-17
0.257
MAK-UNK-ec98eaf6-34
0.256
MAK-UNK-5d2caa6f-13
0.255
MAK-UNK-10799360-17
0.255
MAK-UNK-5d2caa6f-14
0.254
DAR-DIA-3e9bbd81-8
0.254
MAK-UNK-af83ef51-17
0.254
MAK-UNK-df1a028e-7
0.253
DAR-DIA-3e9bbd81-10
0.252
MAK-UNK-90d0606b-3
0.250
MAK-UNK-10799360-5
0.250
MAK-UNK-ec98eaf6-1
0.250
MAK-UNK-5d2caa6f-11
0.250
MAK-UNK-3f402c2b-15
0.250
MAK-UNK-bae89c02-4
0.250
TAM-UNI-d1c3dd9f-3
0.248
MIH-UNI-e573136b-12
0.248
NIR-THE-c331be7a-5
0.248
MAK-UNK-bae89c02-3
0.248
SAD-SAT-9a6c5cf3-7
0.248
JOK-SYG-6ec557d2-1
0.248
MAK-UNK-3f402c2b-2
0.248
MAK-UNK-ec98eaf6-9
0.245
MAK-UNK-3f402c2b-9
0.245
MAK-UNK-3f402c2b-7
0.245
MAK-UNK-5d2caa6f-18
0.244
MAK-UNK-5d2caa6f-15
0.243
MAK-UNK-5d2caa6f-22
0.243
TAM-UNI-c140e31a-7
0.243
STU-CHA-7e77017b-1
0.243
NIR-THE-c331be7a-6
0.243
MAK-UNK-3f402c2b-1
0.242
MAK-UNK-3f402c2b-24
0.242