In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 9th, 2011 | 19 | Yes |
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) | 3.84 | 10.46 | -51.2 | 0 | 4 | -1 | 60 | 270.393 | 12 | ↓ |
Lo Low (pH 4.5-6) | 3.84 | 8.49 | -11.61 | 1 | 4 | 0 | 58 | 271.401 | 12 | ↓ |