In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 24 | 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) | 2.37 | 4.26 | -9.1 | 1 | 4 | 0 | 44 | 324.424 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.37 | 4.65 | -29.31 | 2 | 4 | 1 | 45 | 325.432 | 1 | ↓ |