In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 27 | 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) | -1.32 | -4.72 | -57.78 | 9 | 11 | 1 | 187 | 383.429 | 8 | ↓ |
Lo Low (pH 4.5-6) | -1.32 | -4.46 | -97.72 | 10 | 11 | 2 | 189 | 384.437 | 8 | ↓ |
Lo Low (pH 4.5-6) | -1.32 | -8.84 | -97.19 | 10 | 11 | 2 | 189 | 384.437 | 8 | ↓ |