In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 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) | 0.68 | 1.72 | -33.25 | 4 | 3 | 1 | 60 | 197.283 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.68 | 0.65 | -6.99 | 3 | 3 | 0 | 55 | 196.275 | 4 | ↓ |