In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 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) | 1.40 | 6.73 | -49.39 | 1 | 4 | 0 | 54 | 215.293 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 4.45 | -46.04 | 0 | 4 | -1 | 53 | 214.285 | 4 | ↓ |