In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 9 | 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) | 0.08 | 1.38 | -8.81 | 2 | 3 | 0 | 49 | 124.143 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.08 | 1.57 | -36.09 | 3 | 3 | 1 | 50 | 125.151 | 2 | ↓ |