In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 12th, 2009 | 12 | 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) | -0.54 | 0.05 | -45.24 | 4 | 3 | 1 | 53 | 186.304 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.54 | 1.41 | -112.64 | 5 | 3 | 2 | 57 | 187.312 | 5 | ↓ |