In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 13th, 2007 | 20 | 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) | 4.02 | 0.42 | -37.22 | 1 | 2 | 1 | 17 | 263.364 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.02 | 0.53 | -101.22 | 2 | 2 | 2 | 18 | 264.372 | 2 | ↓ |