In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 18 | 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) | -0.25 | 3.06 | -52.42 | 3 | 5 | -1 | 95 | 249.29 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.25 | 1.26 | -14.05 | 4 | 5 | 0 | 92 | 250.298 | 6 | ↓ |