| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 22 | Yes |
Popular Name: (3S)-3-isopropyl-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one (3S)-3-isopropyl-1-methyl-5-phen…
| 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) | 3.19 | 8.12 | -9.78 | 0 | 3 | 0 | 33 | 292.382 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.19 | 8.9 | -27 | 1 | 3 | 1 | 34 | 293.39 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
