In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2009 | 22 | 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) | 3.55 | 7.08 | -14.65 | 1 | 4 | 0 | 51 | 292.338 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.55 | 7.48 | -44.18 | 2 | 4 | 1 | 52 | 293.346 | 3 | ↓ |