Molecular Properties | |
SMILES: | NS(=O)(=O)c1ccc2ccc(NC3CC4CC3CN4C(=O)CCl)cc2c1 |
MW: | 393.09 |
Fraction sp3: | 0.39 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 92.5 |
cLogP: | 2.13 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
β-Aminonaphtalenes
MED-COV-4280ac29-15
MAK-UNK-ec98eaf6-35
0.553
NIR-THE-0d6461ce-5
0.549
MAK-UNK-ec98eaf6-32
0.525
MAK-UNK-ec98eaf6-43
0.487
MAK-UNK-df1a028e-5
0.424
NIR-THE-0d6461ce-4
0.411
MAK-UNK-3f402c2b-18
0.393
MAK-UNK-10799360-17
0.385
MAK-UNK-10799360-11
0.380
SAD-SAT-f25ee457-8
0.371
MAK-UNK-bae89c02-3
0.365
MAK-UNK-90d0606b-6
0.364
TAM-UNI-d1c3dd9f-3
0.360
NIR-THE-c331be7a-5
0.360
MIH-UNI-e573136b-12
0.360
DAR-DIA-3e9bbd81-10
0.354
MAK-UNK-ec98eaf6-34
0.352
MAK-UNK-5d2caa6f-16
0.352
MAK-UNK-3f402c2b-19
0.348
JAN-GHE-1d98ec1c-1
0.348
MAK-UNK-3e0761f8-1
0.344
MAK-UNK-5d2caa6f-15
0.343
MAK-UNK-5d2caa6f-20
0.341
DAR-DIA-3e9bbd81-9
0.340
SEL-UNI-cd366922-7
0.337
MAK-UNK-5d2caa6f-1
0.337
MAK-UNK-90d0606b-10
0.333
MAK-UNK-3e0761f8-3
0.330
MAK-UNK-5d2caa6f-13
0.330
PET-SGC-85e821e4-1
0.326
MAK-UNK-90d0606b-8
0.323
MAK-UNK-90d0606b-9
0.323
MAK-UNK-3e0761f8-5
0.323
MAK-UNK-5d2caa6f-21
0.323
MAK-UNK-7c9d1431-3
0.322
DRR-IMP-dff87f5e-2
0.322
MAK-UNK-5d2caa6f-17
0.320
MIH-UNI-6b9ca91a-9
0.320
SAD-SAT-581007d4-10
0.319
MAK-UNK-90d0606b-2
0.319
SAD-SAT-89668ff1-4
0.319
MAK-UNK-3f402c2b-5
0.318
MAK-UNK-10799360-7
0.317
MAK-UNK-5d2caa6f-14
0.314
MAK-UNK-3e0761f8-8
0.311
NIM-UNI-b87c0f72-3
0.310
NIM-UNI-b87c0f72-4
0.310
TAM-UNI-d1c3dd9f-6
0.309
MAK-UNK-10799360-29
0.308
MAK-UNK-5d2caa6f-19
0.308
PEI-IMP-e4a008a2-1
0.307
MAK-UNK-3f402c2b-15
0.307
DAR-DIA-fb20be43-9
0.306
MAK-UNK-3f402c2b-28
0.306
MAK-UNK-10799360-9
0.306
MAK-UNK-10799360-30
0.306
MAK-UNK-3e0761f8-6
0.304
MAK-UNK-5d2caa6f-22
0.304
MAK-UNK-3f402c2b-2
0.301
MAK-UNK-ec98eaf6-48
0.300
MIH-UNI-e573136b-4
0.299
NIM-UNI-363644a0-1
0.298
DAR-DIA-caba39e3-10
0.297
MAK-UNK-10799360-34
0.294
DAR-DIA-fb20be43-12
0.293
MAK-UNK-69bf97dd-4
0.291
DAN-MCD-50d01569-1
0.291
MAK-UNK-ec98eaf6-38
0.290
DAR-DIA-3e9bbd81-4
0.288
MAK-UNK-3f402c2b-7
0.287
MAK-UNK-3f402c2b-20
0.287
MAK-UNK-5d2caa6f-18
0.287
MAK-UNK-5d2caa6f-11
0.284
MAK-UNK-3e0761f8-4
0.284
MAK-UNK-ec98eaf6-37
0.282
MAK-UNK-ec98eaf6-5
0.281
MAK-UNK-10799360-14
0.280
MAK-UNK-df1a028e-7
0.280
AMI-CSI-2ea5bed6-10
0.278
MAK-UNK-3f402c2b-22
0.278
MAK-UNK-10799360-4
0.278
DAR-DIA-3e9bbd81-8
0.278
SIM-DEM-5935bd74-4
0.278
MAK-UNK-3f402c2b-11
0.277
MAK-UNK-df1a028e-1
0.277
MAK-UNK-ec98eaf6-7
0.276
MAK-UNK-7c9d1431-23
0.276
MAR-TRE-6a44bbf2-28
0.276
JAY-UNK-11f5bdbd-1
0.276
MAK-UNK-90d0606b-3
0.276
MAK-UNK-bae89c02-4
0.276
MAK-UNK-3f402c2b-12
0.274
MAR-TRE-6a44bbf2-33
0.273
MAK-UNK-3f402c2b-4
0.273
SAD-SAT-5b1897b2-7
0.273
MAK-UNK-3f402c2b-9
0.272
MAK-UNK-df1a028e-6
0.272
DAN-LON-a5fc619e-8
0.272
MAK-UNK-10799360-6
0.271
MAK-UNK-3f402c2b-17
0.271