In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2010 | 21 | 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) | 2.64 | 7.18 | -9.17 | 1 | 4 | 0 | 45 | 281.359 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.64 | 7.81 | -35.4 | 2 | 4 | 1 | 46 | 282.367 | 3 | ↓ |