In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 17 | 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) | 0.39 | 5.91 | -68.67 | 2 | 5 | 0 | 74 | 242.319 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.39 | 3.93 | -41.74 | 3 | 5 | 1 | 71 | 243.327 | 6 | ↓ |