In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 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) | 2.03 | 5.97 | -12.8 | 1 | 3 | 0 | 42 | 244.269 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.03 | 6.39 | -48 | 2 | 3 | 1 | 43 | 245.277 | 3 | ↓ |