In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2006 | 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 | 11.94 | -10.17 | 0 | 4 | 0 | 38 | 365.88 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 12.36 | -32.09 | 1 | 4 | 1 | 39 | 366.888 | 7 | ↓ |