| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 25 | Yes |
Popular Name: (3S)-3-benzyl-5-(2-pyridyl)-1,3-dihydro-1,4-benzodiazepin-2-one (3S)-3-benzyl-5-(2-pyridyl)-1,3-…
| 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) | 3.05 | 7.8 | -10.18 | 1 | 4 | 0 | 54 | 327.387 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.24 | 5.89 | -55.49 | 0 | 4 | -1 | 61 | 326.379 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
