Molecular Properties | |
SMILES: | O=C(CCl)N1CC2CC1CN2C(c1ccccc1)C1CCOCC1 |
MW: | 348.16 |
Fraction sp3: | 0.63 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 4 |
TPSA: | 32.78 |
cLogP: | 2.68 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
MED-COV-4280ac29-15
MAK-UNK-5d2caa6f-4
0.735
MAK-UNK-3e0761f8-9
0.704
MAK-UNK-5d2caa6f-24
0.671
MAK-UNK-df1a028e-9
0.565
MAK-UNK-90d0606b-3
0.545
MAK-UNK-5d2caa6f-3
0.520
GIA-UNK-20b63697-2
0.500
DAR-DIA-3e9bbd81-3
0.476
DAR-DIA-3e9bbd81-7
0.465
MAK-UNK-df1a028e-4
0.456
MAK-UNK-10799360-36
0.443
MAK-UNK-3e0761f8-4
0.437
DAR-DIA-3e9bbd81-5
0.429
MAK-UNK-ec98eaf6-49
0.427
DAR-DIA-3e9bbd81-6
0.426
MAK-UNK-ec98eaf6-51
0.415
AHN-SAT-721e3e40-1
0.412
MAK-UNK-ec98eaf6-6
0.407
MAK-UNK-ec98eaf6-9
0.407
MAK-UNK-ec98eaf6-1
0.393
PEI-IMP-e4a008a2-1
0.380
MAK-UNK-ec98eaf6-8
0.375
MAK-UNK-ec98eaf6-50
0.372
MAK-UNK-3f402c2b-25
0.372
MAK-UNK-ec98eaf6-2
0.370
DAR-DIA-3e9bbd81-14
0.367
DAR-DIA-3e9bbd81-13
0.366
MAK-UNK-ec98eaf6-3
0.364
MAK-UNK-ec98eaf6-53
0.364
MAK-UNK-3f402c2b-7
0.359
MAK-UNK-3f402c2b-4
0.359
MAK-UNK-ec98eaf6-11
0.359
MAK-UNK-3f402c2b-26
0.358
GIA-UNK-20b63697-4
0.357
GIA-UNK-20b63697-6
0.354
MAK-UNK-5d2caa6f-12
0.353
MAK-UNK-ec98eaf6-52
0.350
MAK-UNK-3f402c2b-6
0.349
MAK-UNK-ec98eaf6-15
0.343
MAK-UNK-3f402c2b-16
0.341
MAK-UNK-ec98eaf6-13
0.341
GIA-UNK-20b63697-3
0.341
GIA-UNK-20b63697-5
0.341
MAK-UNK-3f402c2b-13
0.341
MAK-UNK-6ca90168-11
0.338
MAK-UNK-3f402c2b-21
0.337
GIA-UNK-20b63697-8
0.337
GIA-UNK-20b63697-9
0.337
MAK-UNK-90d0606b-1
0.337
MAK-UNK-ec98eaf6-54
0.333
MAK-UNK-3f402c2b-1
0.333
MAK-UNK-3f402c2b-3
0.333
MAK-UNK-10799360-26
0.333
MAK-UNK-3f402c2b-27
0.333
MAK-UNK-3f402c2b-29
0.333
MAK-UNK-3f402c2b-22
0.329
GIA-UNK-c4371e97-2
0.329
MAK-UNK-3f402c2b-11
0.326
MAK-UNK-3f402c2b-5
0.325
MAK-UNK-3f402c2b-2
0.322
DAN-LON-a5fc619e-8
0.321
MAK-UNK-3f402c2b-9
0.321
MAK-UNK-3f402c2b-18
0.321
MAK-UNK-10799360-19
0.320
MAK-UNK-ec98eaf6-7
0.320
MAK-UNK-3f402c2b-17
0.318
MAK-UNK-3f402c2b-24
0.318
MAK-UNK-3e0761f8-8
0.318
MAK-UNK-3f402c2b-14
0.315
MAK-UNK-3f402c2b-15
0.313
DAR-DIA-3e9bbd81-2
0.312
MAK-UNK-df1a028e-1
0.310
SEL-UNI-cd366922-5
0.310
MAK-UNK-ec98eaf6-25
0.308
MAK-UNK-bae89c02-4
0.308
MAK-UNK-10799360-12
0.308
MAK-UNK-3f402c2b-12
0.307
MAK-UNK-ec98eaf6-4
0.307
SAD-SAT-3a925b8b-8
0.306
MAK-UNK-5d2caa6f-7
0.305
MAK-UNK-df1a028e-8
0.305
MAK-UNK-10799360-32
0.303
MAK-UNK-5d2caa6f-20
0.302
MAK-UNK-ec98eaf6-19
0.302
MAK-UNK-bae89c02-3
0.302
MAK-UNK-ec98eaf6-20
0.301
MAK-UNK-ec98eaf6-44
0.300
MAK-UNK-90d0606b-4
0.300
SIM-SYN-f15aaa3a-1
0.299
DAR-DIA-3e9bbd81-1
0.298
MAK-UNK-3e0761f8-10
0.297
MAK-UNK-ec98eaf6-55
0.296
MAR-TRE-8190bb11-56
0.295
MAK-UNK-10799360-10
0.292
GIA-UNK-c4371e97-1
0.292
MAK-UNK-df1a028e-6
0.291
MAK-UNK-5d2caa6f-23
0.290
MAK-UNK-ec98eaf6-24
0.289
MAK-UNK-ec98eaf6-10
0.286
MAK-UNK-ec98eaf6-21
0.286