In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 26 | Yes |
Popular Name: (2S)-2,4-bis(4-chlorophenyl)-2-methyl-1,3-dihydro-1,5-benzodiazepine (2S)-2,4-bis(4-chlorophenyl)-2-m…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 6.87 | 11.99 | -7.4 | 1 | 2 | 0 | 24 | 381.306 | 2 | ↓ |
Lo Low (pH 4.5-6) | 6.87 | 12.37 | -32.53 | 2 | 2 | 1 | 26 | 382.314 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 248 | MolMall (formerly Molecular Diversity Preservation International) |
No pre-computed analogs available. Try a structural similarity search.