In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 9th, 2009 | 16 | 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) | 2.17 | 2.41 | -6.96 | 1 | 3 | 0 | 33 | 221.3 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 4.73 | -40.88 | 2 | 3 | 1 | 34 | 222.308 | 3 | ↓ |