In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2009 | 25 | 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) | 3.89 | 7.51 | -17.05 | 0 | 4 | 0 | 64 | 334.467 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 8.97 | -56.87 | 1 | 4 | 1 | 65 | 335.475 | 2 | ↓ |