In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2009 | 29 | Yes |
None
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) | 5.37 | 13.73 | -37.78 | 1 | 3 | 1 | 13 | 433.378 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.37 | 13.62 | -39.53 | 1 | 3 | 1 | 13 | 433.378 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.37 | 11.37 | -4.4 | 0 | 3 | 0 | 11 | 432.37 | 4 | ↓ |