In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2010 | 18 | 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) | -0.13 | 3.89 | -67.88 | 4 | 5 | 0 | 97 | 250.298 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.13 | 3.56 | -45.84 | 3 | 5 | -1 | 95 | 249.29 | 7 | ↓ |