In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 11 | 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) | -0.62 | 2.1 | -8.92 | 1 | 3 | 0 | 50 | 151.165 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.62 | 2.56 | -40.27 | 2 | 3 | 1 | 51 | 152.173 | 2 | ↓ |