In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 21 | 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) | 3.62 | 8.49 | -11.42 | 0 | 3 | 0 | 31 | 279.339 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 8.84 | -35.44 | 1 | 3 | 1 | 33 | 280.347 | 4 | ↓ |