In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2009 | 17 | 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) | 1.89 | 5.84 | -8.13 | 1 | 4 | 0 | 47 | 229.283 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.89 | 6.31 | -29.24 | 2 | 4 | 1 | 48 | 230.291 | 2 | ↓ |