In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 20th, 2010 | 20 | 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) | 3.79 | 7.2 | -8.72 | 1 | 3 | 0 | 36 | 270.376 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 7.52 | -23.4 | 2 | 3 | 1 | 38 | 271.384 | 3 | ↓ |