In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 15 | 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) | -1.10 | -1.71 | -48.18 | 4 | 5 | 1 | 72 | 216.305 | 7 | ↓ |
Lo Low (pH 4.5-6) | -1.10 | 0.57 | -112.48 | 5 | 5 | 2 | 73 | 217.313 | 7 | ↓ |