In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 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) | 3.60 | 5.34 | -10.07 | 2 | 3 | 0 | 45 | 284.746 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.60 | 5.73 | -32.26 | 3 | 3 | 1 | 46 | 285.754 | 3 | ↓ |