In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2009 | 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) | 1.85 | 12.49 | -51.05 | 1 | 10 | 1 | 96 | 469.566 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.85 | 10.23 | -16.76 | 0 | 10 | 0 | 95 | 468.558 | 9 | ↓ |