In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2011 | 22 | 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) | 3.94 | 9.02 | -51.11 | 1 | 5 | -1 | 78 | 306.382 | 11 | ↓ |
Lo Low (pH 4.5-6) | 3.94 | 7.04 | -12.42 | 2 | 5 | 0 | 76 | 307.39 | 11 | ↓ |