In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 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) | 3.71 | 11.32 | -51.8 | 2 | 8 | 1 | 81 | 459.574 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 8.95 | -10.12 | 1 | 8 | 0 | 79 | 458.566 | 6 | ↓ |