In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 30 | 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) | 0.97 | 8.98 | -88.68 | 2 | 6 | 0 | 82 | 421.419 | 3 | ↓ |
Mid Mid (pH 6-8) | -1.77 | 8.03 | -67.97 | 3 | 6 | 1 | 85 | 422.427 | 2 | ↓ |