In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 17 | 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) | 1.65 | 3.26 | -11.71 | 2 | 4 | 0 | 69 | 247.323 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 3.8 | -30.6 | 3 | 4 | 1 | 70 | 248.331 | 4 | ↓ |