In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 11th, 2006 | 28 | No |
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) | 3.40 | 9.35 | -58.56 | 0 | 5 | -1 | 74 | 380.395 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.40 | 8.6 | -14.09 | 1 | 5 | 0 | 71 | 381.403 | 5 | ↓ |