In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2010 | 16 | No |
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) | -0.40 | 0.89 | -8.13 | 2 | 6 | 0 | 74 | 222.248 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.40 | 1.25 | -31.44 | 3 | 6 | 1 | 76 | 223.256 | 3 | ↓ |