In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 54 | No |
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) | -5.54 | 2.32 | -335.39 | 17 | 18 | 5 | 286 | 774.09 | 24 | ↓ |
Mid Mid (pH 6-8) | -5.54 | 2.7 | -451.51 | 18 | 18 | 6 | 288 | 775.098 | 24 | ↓ |