In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2011 | 38 | 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) | 8.51 | 17.97 | -13.59 | 1 | 5 | 0 | 51 | 504.63 | 5 | ↓ |
Mid Mid (pH 6-8) | 8.51 | 18.22 | -78.87 | 2 | 5 | 0 | 52 | 505.638 | 5 | ↓ |