In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 2nd, 2011 | 19 | 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) | 2.05 | 9.93 | -190.71 | 0 | 6 | -3 | 120 | 271.289 | 11 | ↓ |
Lo Low (pH 4.5-6) | 2.05 | 7.95 | -112.33 | 1 | 6 | -2 | 118 | 272.297 | 11 | ↓ |