In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 23 | Yes |
None
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) | 0.88 | 2.36 | -41.87 | 3 | 6 | 1 | 66 | 339.382 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.88 | 2.42 | -38.26 | 3 | 6 | 1 | 66 | 339.382 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.88 | 0.18 | -12.84 | 2 | 6 | 0 | 65 | 338.374 | 7 | ↓ |