Molecular Properties | |
SMILES: | CC(=O)Nc1cccc(N2C(=O)CCC2C)c1 |
MW: | 232.12 |
Fraction sp3: | 0.38 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 49.41 |
cLogP: | 2.16 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
LON-WEI-8f408cad-3
MAK-UNK-7a704a63-12
0.533
MAK-UNK-c8c8f7e2-42
0.516
MAK-UNK-c8c8f7e2-43
0.500
MAK-UNK-6435e6c2-4
0.492
MAK-UNK-c8c8f7e2-26
0.484
MAK-UNK-7a704a63-13
0.484
MAK-UNK-7a704a63-14
0.470
MAK-UNK-c8c8f7e2-28
0.470
MAK-UNK-c8c8f7e2-21
0.469
MAK-UNK-7a704a63-1
0.468
MAK-UNK-c8c8f7e2-14
0.460
MAK-UNK-7a704a63-2
0.460
MAK-UNK-c8c8f7e2-13
0.453
MAK-UNK-7a704a63-3
0.453
MAK-UNK-c8c8f7e2-27
0.453
MAK-UNK-c8c8f7e2-24
0.448
MAK-UNK-c8c8f7e2-29
0.448
MAK-UNK-c8c8f7e2-25
0.441
MAK-UNK-7a704a63-15
0.441
MAK-UNK-c8c8f7e2-30
0.438
MAK-UNK-c8c8f7e2-22
0.426
MAK-UNK-c8c8f7e2-23
0.420
MAK-UNK-c8c8f7e2-19
0.379
MAK-UNK-7a704a63-8
0.373
MAK-UNK-c8c8f7e2-15
0.373
MAK-UNK-7a704a63-9
0.371
MAK-UNK-c8c8f7e2-16
0.357
MAK-UNK-10dfa458-22
0.352
MAK-UNK-c8c8f7e2-17
0.342
LON-WEI-8f408cad-1
0.333
MAK-UNK-7a704a63-10
0.333
AAR-POS-0daf6b7e-11
0.333
MAK-UNK-10dfa458-3
0.333
MAK-UNK-c8c8f7e2-18
0.320
MAK-UNK-7a704a63-23
0.319
JAG-UCB-ef2c0e8e-2
0.314
MAK-UNK-c8c8f7e2-10
0.314
MAK-UNK-7a704a63-5
0.314
MAK-UNK-7a704a63-16
0.310
MAK-UNK-c8c8f7e2-39
0.310
MAK-UNK-9159f8ed-5
0.300
RAL-MED-2de63afb-11
0.297
MAK-UNK-7a704a63-22
0.297
MAR-TRE-a9136c7b-42
0.296
MAK-UNK-c8c8f7e2-40
0.296
MAK-UNK-7a704a63-17
0.296
WIL-LEE-23e8b574-8
0.295
MAK-UNK-902cc841-3
0.292
MAK-UNK-c8c8f7e2-11
0.292
MAK-UNK-7a704a63-6
0.292
AAR-UNI-c25c2f1e-93
0.291
MAK-UNK-9159f8ed-6
0.291
MAK-UNK-1e8f9e3c-1
0.291
MAK-UNK-9159f8ed-1
0.290
MAR-TRE-a9136c7b-57
0.289
BAR-COM-0f94fc3d-53
0.289
MAK-UNK-9159f8ed-2
0.286
RAL-MED-2de63afb-10
0.286
JOH-UNI-c7afdb96-8
0.284
MAK-UNK-902cc841-4
0.283
MAK-UNK-1e8f9e3c-2
0.281
JAG-UCB-ef2c0e8e-10
0.280
MAK-UNK-9159f8ed-3
0.279
BAR-COM-4e090d3a-60
0.279
MAK-UNK-1e8f9e3c-3
0.279
MAK-UNK-1e8f9e3c-5
0.279
MAK-UNK-10dfa458-25
0.278
MAK-UNK-7a704a63-20
0.278
SWA-SYN-d2e6fa14-10
0.276
SWA-SYN-6423ea73-9
0.276
IND-SYN-6c8299e8-8
0.276
LON-WEI-120e5cf5-19
0.275
RAL-MED-2de63afb-8
0.274
UNK-CYC-68f84b31-32
0.267
MAK-UNK-1e8f9e3c-4
0.267
SAD-SAT-24589cd1-2
0.266
RAL-MED-2de63afb-9
0.263
NAU-LAT-ec9c7557-1
0.263
MAK-UNK-9159f8ed-4
0.260
MAR-TRE-85681e92-58
0.260
JOH-UNI-c7afdb96-7
0.260
FAR-UNI-736b943a-7
0.258
AAR-POS-fca48359-9
0.258
UNK-CYC-68f84b31-13
0.258
UNK-CYC-68f84b31-43
0.255
ERI-UCB-d6de1f3c-7
0.255
RIT-AID-d1f3f5d2-1
0.255
JOH-UNI-c7afdb96-6
0.253
WIL-UNI-1faa9b10-23
0.253
MAR-TRE-66ac689e-72
0.250
MAK-UNK-10dfa458-32
0.250
AAR-UNI-c25c2f1e-61
0.250
BAR-COM-4e090d3a-53
0.250
MAK-UNK-c8c8f7e2-38
0.250
MAK-UNK-7a704a63-21
0.250
MAK-UNK-c8c8f7e2-37
0.250
AAR-UNI-c25c2f1e-53
0.247
TRY-UNI-9f475305-10
0.247
MAK-UNK-7a704a63-24
0.247
MAK-UNK-129dcd6f-6
0.247