Molecular Properties | |
SMILES: | Cc1cccnc1NC(=O)C1CC2CC1CN2C(=O)CCl |
MW: | 307.11 |
Fraction sp3: | 0.53 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 62.3 |
cLogP: | 1.8 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
MED-COV-4280ac29-15
MAK-UNK-3e0761f8-5
0.584
MAK-UNK-5d2caa6f-1
0.573
MAK-UNK-5d2caa6f-20
0.548
MAK-UNK-3f402c2b-19
0.533
MAK-UNK-3e0761f8-1
0.526
LON-WEI-120e5cf5-21
0.526
MAK-UNK-90d0606b-8
0.525
MAK-UNK-5d2caa6f-16
0.520
MAK-UNK-90d0606b-10
0.519
MAK-UNK-5d2caa6f-21
0.513
MAK-UNK-5d2caa6f-22
0.488
MAK-UNK-5d2caa6f-13
0.488
MAK-UNK-90d0606b-2
0.487
MAK-UNK-3e0761f8-3
0.483
MAK-UNK-5d2caa6f-19
0.472
MAK-UNK-5d2caa6f-17
0.460
MAK-UNK-5d2caa6f-15
0.455
MAK-UNK-3e0761f8-8
0.430
MAK-UNK-5d2caa6f-14
0.430
MAK-UNK-5d2caa6f-18
0.430
MAK-UNK-ec98eaf6-5
0.410
MAK-UNK-3f402c2b-28
0.395
MAK-UNK-ec98eaf6-32
0.393
MAK-UNK-3e0761f8-6
0.376
MAK-UNK-3f402c2b-20
0.372
MAK-UNK-ec98eaf6-43
0.357
MAK-UNK-3f402c2b-18
0.349
MAK-UNK-df1a028e-5
0.349
MAK-UNK-10799360-24
0.347
MAK-UNK-10799360-25
0.344
MAK-UNK-ec98eaf6-38
0.337
MAK-UNK-10799360-34
0.337
MAK-UNK-10799360-6
0.337
MAK-UNK-ec98eaf6-37
0.323
MAK-UNK-ec98eaf6-36
0.323
LON-WEI-4d77710c-21
0.323
LON-WEI-5e7d1b3e-21
0.323
MIK-MCD-8542a490-1
0.313
MAK-UNK-5d2caa6f-11
0.311
MAK-UNK-ec98eaf6-48
0.302
THO-SYG-f9b2970d-1
0.302
MAK-UNK-3e0761f8-7
0.299
MAK-UNK-3f402c2b-3
0.299
THO-SYG-f9b2970d-2
0.295
MAK-UNK-90d0606b-1
0.292
MAK-UNK-3f402c2b-4
0.289
MAK-UNK-3f402c2b-7
0.289
MAK-UNK-3f402c2b-12
0.289
MAK-UNK-ec98eaf6-1
0.289
MAK-UNK-c97f7c8f-1
0.287
DAN-LON-a5fc619e-8
0.287
MAK-UNK-3e0761f8-4
0.286
DAV-CRI-1c77f7a9-5
0.284
MAK-UNK-ec98eaf6-20
0.284
MAK-UNK-ec98eaf6-9
0.284
LON-WEI-120e5cf5-11
0.284
MAK-UNK-ec98eaf6-35
0.283
MAK-UNK-3f402c2b-27
0.282
MAK-UNK-10799360-7
0.282
SAD-SAT-29425be4-5
0.281
IAN-BAS-d38e7e67-1
0.281
MAK-UNK-df1a028e-7
0.281
SWA-SYN-d2e6fa14-6
0.279
SWA-SYN-6423ea73-6
0.279
MAK-UNK-3f402c2b-22
0.279
STU-CHA-464c0256-1
0.278
MAK-UNK-10799360-36
0.278
LON-WEI-120e5cf5-13
0.278
MAC-MCD-4707377b-1
0.278
MAK-UNK-7c9d1431-20
0.277
NIR-THE-0d6461ce-11
0.277
TAT-ENA-80bfd3e5-30
0.276
MAK-UNK-3f402c2b-5
0.276
MAK-UNK-3f402c2b-2
0.275
MAK-UNK-df1a028e-4
0.275
MAK-UNK-3f402c2b-29
0.274
MAK-UNK-df1a028e-6
0.273
MAK-UNK-3f402c2b-9
0.273
MAK-UNK-3f402c2b-17
0.272
WAR-XCH-b0339bbe-3
0.271
MAK-UNK-df1a028e-8
0.271
MAK-UNK-3f402c2b-25
0.271
MAK-UNK-ec98eaf6-10
0.270
JAS-UNI-326cae60-2
0.269
MAK-UNK-bae89c02-2
0.269
THO-SYG-f9b2970d-6
0.269
MAK-UNK-ec98eaf6-44
0.269
DAN-LON-a5fc619e-7
0.268
MAK-UNK-df1a028e-9
0.267
MAK-UNK-10799360-19
0.267
DAV-CRI-1c77f7a9-6
0.267
MAK-UNK-10799360-11
0.267
MAK-UNK-ec98eaf6-33
0.267
MAK-UNK-ec98eaf6-14
0.266
MAK-UNK-ec98eaf6-17
0.265
LON-WEI-120e5cf5-7
0.265
PEI-IMP-e4a008a2-1
0.264
MAK-UNK-5d2caa6f-3
0.264
MAK-UNK-ec98eaf6-13
0.264
MAK-UNK-df1a028e-1
0.264