In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2008 | 35 | 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) | 2.65 | 10.23 | -20.51 | 1 | 8 | 0 | 89 | 475.593 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 10.68 | -50.78 | 2 | 8 | 1 | 91 | 476.601 | 5 | ↓ |