In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2011 | 20 | 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) | 7.08 | 13.06 | -2.78 | 0 | 1 | 0 | 3 | 279.443 | 11 | ↓ |
Lo Low (pH 4.5-6) | 7.08 | 13.11 | -20.99 | 1 | 1 | 0 | 4 | 280.451 | 11 | ↓ |