In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2010 | 26 | 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) | 6.35 | 14.39 | -10.28 | 0 | 3 | 0 | 27 | 350.506 | 10 | ↓ |
Mid Mid (pH 6-8) | 6.35 | 14.68 | -30.35 | 1 | 3 | 1 | 28 | 351.514 | 10 | ↓ |