In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2008 | 32 | 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) | 1.49 | -0.23 | -23.55 | 1 | 10 | 0 | 122 | 489.616 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.49 | 1.9 | -51.05 | 2 | 10 | 1 | 124 | 490.624 | 7 | ↓ |