In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 18 | 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) | 3.82 | 5.36 | -6.68 | 2 | 3 | 0 | 52 | 321.199 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.82 | 5.32 | -28.9 | 3 | 3 | 1 | 53 | 322.207 | 2 | ↓ |