Molecular Properties | |
SMILES: | O=C(Nc1cccnc1)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O |
MW: | 347.09 |
Fraction sp3: | 0.05 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 92.51 |
cLogP: | 2.72 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z31790652 |
Enamine Extended REAL: | s_22____57778____60340 |
Mcule: | MCULE-9180454558 |
MolPort: | MolPort-002-276-847 |
phthalimide
ALE-HEI-f28a35b5-9
MAR-TRE-b77b7921-70
0.679
KEI-TRE-d5e2018a-58
0.617
MAR-TRE-4b834d9a-43
0.617
MAR-TRE-3e4e6814-45
0.413
CHR-SOS-7098f804-12
0.395
MAR-TRE-67513f76-87
0.386
KEI-TRE-d5e2018a-22
0.383
MAR-TRE-2fd8122f-95
0.380
MAR-TRE-2fd8122f-41
0.375
MAR-TRE-9c797165-8
0.374
KEI-TRE-d5e2018a-90
0.357
KEI-TRE-d5e2018a-32
0.355
MAR-TRE-3e4e6814-34
0.355
KEI-TRE-d5e2018a-36
0.354
KEI-TRE-d5e2018a-28
0.351
MAR-TRE-f6f5f473-29
0.351
KEI-TRE-d5e2018a-86
0.351
MAR-TRE-4b834d9a-57
0.351
MAR-TRE-9c797165-31
0.350
MAR-TRE-4b834d9a-92
0.347
MAR-TRE-04c86cea-90
0.340
MAR-TRE-f6f5f473-75
0.340
MAR-TRE-2fd8122f-60
0.337
MAR-TRE-2fd8122f-58
0.337
MAR-TRE-2fd8122f-72
0.337
MAR-TRE-f6f5f473-79
0.337
MAR-TRE-4b834d9a-67
0.333
MAR-TRE-f6f5f473-36
0.333
CHR-SOS-7098f804-18
0.330
MAR-TRE-2fd8122f-86
0.327
MAR-TRE-f6f5f473-58
0.327
KEI-TRE-d5e2018a-70
0.327
MAR-TRE-74c6519b-58
0.326
CHR-SOS-7098f804-14
0.326
MAK-UNK-ca11b4f7-1
0.325
MAR-TRE-04c86cea-65
0.324
MAR-TRE-2fd8122f-22
0.323
MAR-TRE-2fd8122f-31
0.323
ANT-DIA-3c79be55-4
0.322
MAR-TRE-4b834d9a-24
0.321
MAR-TRE-4b834d9a-71
0.321
KEI-TRE-d5e2018a-100
0.320
MAR-TRE-67513f76-51
0.320
MAR-TRE-2fd8122f-82
0.320
MAK-UNK-d1e89583-9
0.319
MAR-TRE-3e4e6814-93
0.319
CHR-SOS-7098f804-11
0.318
ALE-HEI-f28a35b5-14
0.317
MAR-TRE-67513f76-81
0.316
MAR-TRE-2fd8122f-71
0.315
KEI-TRE-d5e2018a-82
0.314
KEI-TRE-d5e2018a-71
0.314
MAK-UNK-ca11b4f7-3
0.312
KEI-TRE-d5e2018a-52
0.310
EMI-TUK-a58865cc-1
0.309
CHR-SOS-7098f804-16
0.309
JOH-IMS-62aeb97d-5
0.308
KEI-TRE-d5e2018a-91
0.307
KEI-TRE-d5e2018a-63
0.306
MAK-UNK-129dcd6f-9
0.306
MAR-TRE-74c6519b-42
0.306
MAR-TRE-c317dd82-59
0.306
CHR-SOS-7098f804-15
0.306
MAR-TRE-2fd8122f-34
0.306
CHR-SOS-7098f804-13
0.305
KEI-TRE-d5e2018a-61
0.304
MAR-TRE-3e4e6814-92
0.304
JAN-GHE-4287bd1a-9
0.303
MAR-TRE-2fd8122f-65
0.303
JOH-IMS-62aeb97d-4
0.302
WIL-UNI-5578df48-2
0.301
ALE-HEI-f28a35b5-15
0.301
KEI-TRE-d5e2018a-9
0.301
KEI-TRE-d5e2018a-13
0.301
MAR-TRE-f6f5f473-46
0.300
MAK-UNK-10dfa458-24
0.300
MAR-TRE-2fd8122f-40
0.300
KEI-TRE-d5e2018a-56
0.298
SAN-PRS-52b81272-2
0.298
MAR-TRE-2fd8122f-15
0.297
MAR-TRE-3e4e6814-66
0.297
KEI-TRE-d5e2018a-10
0.297
JOH-UNI-abdb2f0c-1
0.297
AAR-POS-d2a4d1df-11
0.296
JOH-UNI-abdb2f0c-2
0.296
MAR-TRE-3e4e6814-59
0.296
DAR-DIA-23aa0b97-16
0.295
MAK-UNK-ca11b4f7-2
0.295
ANT-DIA-3c79be55-5
0.295
MAR-TRE-2fd8122f-24
0.294
FRA-FAC-9ed5a63a-4
0.293
MAR-TRE-2fd8122f-54
0.293
MAR-TRE-b77b7921-78
0.292
KEI-TRE-d5e2018a-53
0.292
DAR-DIA-842b4336-13
0.292
EDG-MED-0da5ad92-2
0.292
DAR-DIA-842b4336-11
0.292
ALE-HEI-f28a35b5-5
0.292
MAR-TRE-b77b7921-91
0.292
MAR-TRE-2fd8122f-62
0.291