In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 13 | 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) | 1.14 | 0.05 | -8.9 | 3 | 3 | 0 | 59 | 174.203 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.14 | 0.49 | -30.17 | 4 | 3 | 1 | 60 | 175.211 | 1 | ↓ |