In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 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) | 2.88 | 7.95 | -48.9 | 3 | 3 | 1 | 45 | 260.405 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 8.38 | -79.45 | 4 | 3 | 2 | 47 | 261.413 | 7 | ↓ |