In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2009 | 13 | 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) | 0.55 | 3.73 | -87.04 | 3 | 3 | 2 | 24 | 187.331 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 1.36 | -37.81 | 2 | 3 | 1 | 23 | 186.323 | 5 | ↓ |