In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 20 | 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) | 1.45 | 6.68 | -13.75 | 0 | 4 | 0 | 42 | 270.332 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.45 | 7.14 | -40.66 | 1 | 4 | 1 | 44 | 271.34 | 5 | ↓ |