In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2010 | 12 | 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) | -0.82 | 2.97 | -110.15 | 4 | 4 | 1 | 72 | 173.236 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.82 | 2.69 | -43.67 | 3 | 4 | 0 | 71 | 172.228 | 3 | ↓ |