Molecular Properties | |
SMILES: | CC1(C)CN(C(=O)C2CCN(C(=O)CCl)CC2)CC1N |
MW: | 301.16 |
Fraction sp3: | 0.86 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 66.64 |
cLogP: | 0.66 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
MAK-UNK-750cfbcc-5
0.547
MAR-TRE-6a44bbf2-79
0.538
MAK-UNK-750cfbcc-3
0.538
VIR-GIT-7b3d3065-2
0.519
AAR-POS-0daf6b7e-9
0.519
MAK-UNK-750cfbcc-4
0.508
MAR-TRE-6a44bbf2-66
0.508
MAK-UNK-704ed37c-1
0.491
MAK-UNK-704ed37c-4
0.483
MAK-UNK-704ed37c-3
0.483
MAK-UNK-704ed37c-7
0.475
MAK-UNK-750cfbcc-1
0.471
MAK-UNK-750cfbcc-2
0.463
VIR-GIT-7b3d3065-3
0.448
AAR-POS-0daf6b7e-19
0.448
MAK-UNK-704ed37c-5
0.433
MAK-UNK-704ed37c-2
0.426
MAK-UNK-704ed37c-6
0.419
MAK-UNK-704ed37c-9
0.413
MAK-UNK-704ed37c-8
0.413
SAD-SAT-d8079f6f-4
0.412
SAD-SAT-5b1897b2-9
0.407
SAD-SAT-f2e2579e-5
0.392
MAK-UNK-c97f7c8f-1
0.391
SAD-SAT-9a6c5cf3-5
0.382
YOI-UNK-15f562e8-5
0.381
LON-WEI-120e5cf5-5
0.373
SAD-SAT-f2e2579e-3
0.368
SAD-SAT-29425be4-26
0.365
MAK-UNK-6c8f5f75-1
0.364
SAD-SAT-9a6c5cf3-2
0.362
LON-WEI-120e5cf5-10
0.362
MAK-UNK-c97f7c8f-2
0.361
SAD-SAT-f2e2579e-10
0.359
SAD-SAT-9a6c5cf3-10
0.359
MAR-TRE-6a44bbf2-86
0.358
LON-WEI-120e5cf5-15
0.358
SAD-SAT-9a6c5cf3-7
0.358
YOI-UNK-12211982-2
0.356
YOI-UNK-a533afbc-2
0.356
SAD-SAT-29425be4-21
0.356
LON-WEI-120e5cf5-13
0.356
SAD-SAT-d8079f6f-5
0.353
LON-WEI-120e5cf5-20
0.353
JAR-IMP-ed466bb3-20
0.350
LON-WEI-120e5cf5-8
0.349
SAD-SAT-d8079f6f-6
0.346
SAD-SAT-f2e2579e-6
0.346
LON-WEI-120e5cf5-3
0.342
SAD-SAT-f2e2579e-4
0.341
SAD-SAT-9a6c5cf3-9
0.341
MAK-UNK-4b073b5c-16
0.340
WAR-XCH-b0339bbe-18
0.339
SAD-SAT-f2e2579e-8
0.337
LON-WEI-120e5cf5-16
0.333
SAD-SAT-f2e2579e-7
0.333
SAD-SAT-f2e2579e-9
0.333
SAD-SAT-9a6c5cf3-6
0.333
SAD-SAT-1b030f84-9
0.333
LON-WEI-120e5cf5-19
0.333
AAR-POS-f650c5f2-4
0.329
AAR-POS-5507155c-2
0.329
LON-WEI-120e5cf5-17
0.329
LON-WEI-120e5cf5-1
0.329
LON-WEI-120e5cf5-11
0.329
BEN-DND-76ad4ac9-4
0.329
SAD-SAT-d8079f6f-3
0.327
YOI-UNK-12211982-6
0.325
YOI-UNK-a533afbc-6
0.325
MAR-TRE-6a44bbf2-15
0.324
AAR-POS-0daf6b7e-6
0.324
SAD-SAT-f2e2579e-2
0.322
VIK-SYN-bf9c9ac8-1
0.322
YOI-UNK-15f562e8-4
0.322
AAR-POS-0daf6b7e-21
0.321
SAD-SAT-29425be4-20
0.321
SAD-SAT-29425be4-2
0.318
SAD-SAT-29425be4-13
0.316
SAD-SAT-29425be4-19
0.316
SAD-SAT-29425be4-14
0.316
LON-WEI-120e5cf5-21
0.316
MAK-UNK-704ed37c-12
0.316
SAD-SAT-9a6c5cf3-4
0.315
MAK-UNK-704ed37c-11
0.315
SAD-SAT-29425be4-23
0.309
VIK-SYN-9a3d118a-8
0.307
SAD-SAT-65574d3f-6
0.306
MAK-UNK-95198336-3
0.306
NIR-THE-0d6461ce-8
0.306
SAD-SAT-9a6c5cf3-1
0.304
LON-WEI-120e5cf5-4
0.304
SAD-SAT-29425be4-15
0.304
NIR-THE-0d6461ce-9
0.301
SAD-SAT-9a6c5cf3-3
0.301
SAD-SAT-29425be4-28
0.300
LON-WEI-120e5cf5-12
0.300
MAK-UNK-704ed37c-14
0.300
SAD-SAT-29425be4-6
0.300
SAD-SAT-edc8a235-7
0.300
MAK-UNK-704ed37c-16
0.300