In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 15 | 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) | 2.46 | 6.79 | -13.81 | 0 | 2 | 0 | 30 | 197.237 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.46 | 7.19 | -35.14 | 1 | 2 | 1 | 31 | 198.245 | 2 | ↓ |