In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 12 | 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) | 1.48 | 3.49 | -7.19 | 2 | 3 | 0 | 44 | 167.256 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.48 | 3.61 | -24.67 | 3 | 3 | 1 | 45 | 168.264 | 2 | ↓ |