In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 24 | 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) | 3.88 | 11.79 | -41.73 | 2 | 5 | 1 | 57 | 360.532 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.88 | 11.28 | -13.12 | 1 | 5 | 0 | 56 | 359.524 | 6 | ↓ |