In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 34 | 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) | 3.41 | 8.73 | -48.43 | 3 | 7 | 1 | 81 | 499.06 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.41 | 7.7 | -52.53 | 3 | 7 | 1 | 84 | 499.06 | 7 | ↓ |