In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 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) | 1.03 | 6.71 | -11.43 | 1 | 4 | 0 | 47 | 229.283 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.03 | 7.22 | -39.71 | 2 | 4 | 1 | 48 | 230.291 | 4 | ↓ |