In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 17 | 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) | 0.99 | 3.92 | -50.37 | 2 | 4 | 1 | 46 | 300.176 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.99 | 2.54 | -8.97 | 1 | 4 | 0 | 42 | 299.168 | 2 | ↓ |