Molecular Properties | |
SMILES: | CSc1c(NC(C)=O)cccc1N1CCCC1=O |
MW: | 264.09 |
Fraction sp3: | 0.38 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 49.41 |
cLogP: | 2.49 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
LON-WEI-8f408cad-3
MAK-UNK-7a704a63-19
0.550
MAK-UNK-c8c8f7e2-36
0.550
MAK-UNK-7a704a63-21
0.524
MAK-UNK-c8c8f7e2-37
0.524
MAK-UNK-6435e6c2-4
0.415
MAK-UNK-7a704a63-4
0.403
MAK-UNK-c8c8f7e2-9
0.403
MAK-UNK-c8c8f7e2-39
0.403
MAK-UNK-7a704a63-16
0.403
MAK-UNK-7a704a63-22
0.386
MAK-UNK-c8c8f7e2-41
0.382
MAK-UNK-7a704a63-18
0.382
MAK-UNK-c8c8f7e2-15
0.368
MAK-UNK-7a704a63-8
0.368
MAK-UNK-7a704a63-24
0.366
AAR-UNI-c25c2f1e-15
0.354
MAK-UNK-c8c8f7e2-16
0.352
MAK-UNK-7a704a63-23
0.352
MAK-UNK-7a704a63-20
0.348
MAK-UNK-7a704a63-17
0.348
MAK-UNK-c8c8f7e2-40
0.348
MAK-UNK-7a704a63-5
0.348
MAK-UNK-c8c8f7e2-10
0.348
MAK-UNK-7a704a63-9
0.347
MAK-UNK-7a704a63-6
0.343
MAK-UNK-c8c8f7e2-11
0.343
MAK-UNK-c8c8f7e2-3
0.343
MAK-UNK-c8c8f7e2-12
0.338
MAK-UNK-7a704a63-7
0.338
MAK-UNK-c8c8f7e2-17
0.338
MAK-UNK-902cc841-3
0.333
MAK-UNK-10dfa458-3
0.329
AAR-POS-0daf6b7e-11
0.329
MAK-UNK-7a704a63-10
0.329
MAK-UNK-10dfa458-22
0.329
LON-WEI-8f408cad-1
0.329
MAK-UNK-c8c8f7e2-20
0.329
MAK-UNK-c8c8f7e2-1
0.329
MAK-UNK-c8c8f7e2-30
0.329
MAK-UNK-c8c8f7e2-6
0.324
MAK-UNK-7a704a63-11
0.324
MAK-UNK-c8c8f7e2-4
0.324
MAK-UNK-c8c8f7e2-2
0.324
MAK-UNK-c8c8f7e2-18
0.316
MAK-UNK-c8c8f7e2-5
0.303
MAR-TRE-67513f76-4
0.303
MAK-UNK-9159f8ed-6
0.302
MAK-UNK-1e8f9e3c-1
0.302
MAK-UNK-c8c8f7e2-34
0.301
MAK-UNK-c8c8f7e2-7
0.299
MAK-UNK-902cc841-4
0.293
MAK-UNK-1e8f9e3c-2
0.292
MAK-UNK-1e8f9e3c-4
0.292
MAK-UNK-c8c8f7e2-8
0.286
MAK-UNK-9159f8ed-5
0.283
MAK-UNK-9159f8ed-7
0.281
MAK-UNK-1e8f9e3c-5
0.276
MAK-UNK-1e8f9e3c-3
0.276
MAK-UNK-9159f8ed-3
0.276
MAK-UNK-7a704a63-2
0.274
MAK-UNK-c8c8f7e2-14
0.274
JAR-IMP-ed466bb3-5
0.272
MAK-UNK-9159f8ed-4
0.271
MAK-UNK-c8c8f7e2-13
0.270
MAK-UNK-7a704a63-3
0.270
MAK-UNK-c8c8f7e2-43
0.270
MAK-UNK-1e8f9e3c-6
0.270
MAK-UNK-9159f8ed-2
0.269
MAK-UNK-c8c8f7e2-33
0.267
MAK-UNK-c8c8f7e2-42
0.267
MAR-TRE-2fd8122f-39
0.264
MAK-UNK-10dfa458-25
0.261
AAR-UNI-c25c2f1e-61
0.261
MAK-UNK-9159f8ed-1
0.260
MAK-UNK-c8c8f7e2-31
0.260
MAR-TRE-799db12b-49
0.258
MAK-UNK-7a704a63-12
0.257
MAK-UNK-c8c8f7e2-32
0.253
MAK-UNK-7a704a63-15
0.253
MAR-TRE-7f7bb9f0-54
0.253
AAR-UNI-c25c2f1e-103
0.250
JON-UNI-bb9dc649-19
0.250
MAR-TRE-799db12b-69
0.250
MAR-TRE-7f7bb9f0-31
0.250
MAK-UNK-c8c8f7e2-44
0.250
DAV-CRI-8c8dd668-1
0.245
DOU-UNK-b5326f8f-9
0.245
BAR-COM-0f94fc3d-53
0.245
MAK-UNK-7a704a63-1
0.243
MAK-UNK-10dfa458-23
0.242
WIL-LEE-1f71e281-4
0.241
MAK-UNK-c8c8f7e2-26
0.240
MAK-UNK-7a704a63-13
0.240
MAK-UNK-c8c8f7e2-27
0.237
MAK-UNK-10dfa458-32
0.235
BEN-DND-22e6b372-4
0.235
MAK-UNK-c8c8f7e2-21
0.234
MAR-TRE-67513f76-35
0.228
KRI-MAR-d2e3ef86-12
0.228
MAK-UNK-c8c8f7e2-19
0.227