In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2010 | 14 | 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) | 0.89 | 2.84 | -128.98 | 5 | 3 | 2 | 53 | 196.294 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.89 | 1.76 | -46.38 | 4 | 3 | 1 | 49 | 195.286 | 5 | ↓ |