In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 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) | 2.52 | 7.13 | -46.11 | 3 | 3 | 1 | 44 | 236.383 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 7.03 | -100.92 | 4 | 3 | 2 | 45 | 237.391 | 6 | ↓ |