| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 24 | Yes |
Popular Name: 2-(8-chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl)acetonitrile 2-(8-chloro-6-phenyl-4H-[1,2,4]t…
| 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) | 2.27 | 9.16 | -12.83 | 0 | 5 | 0 | 67 | 333.782 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 10 | -40.14 | 1 | 5 | 1 | 68 | 334.79 | 2 | ↓ |
