In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 36 | 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) | 7.53 | 14.43 | -153.11 | 7 | 4 | 3 | 70 | 489.772 | 10 | ↓ |
Mid Mid (pH 6-8) | 7.53 | 14.2 | -72.44 | 6 | 4 | 2 | 69 | 488.764 | 10 | ↓ |