In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 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) | 1.36 | 3.19 | -54.49 | 3 | 5 | -1 | 95 | 249.29 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.36 | 2.07 | -15.01 | 4 | 5 | 0 | 92 | 250.298 | 8 | ↓ |