In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 39 | 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) | 6.59 | 15.89 | -14.73 | 1 | 4 | 0 | 42 | 526.627 | 9 | ↓ |
Mid Mid (pH 6-8) | 6.59 | 17.83 | -42.9 | 2 | 4 | 1 | 43 | 527.635 | 9 | ↓ |