In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 21 | 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 | 6.12 | -35.27 | 2 | 4 | 1 | 42 | 295.447 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 8.1 | -88.56 | 3 | 4 | 2 | 43 | 296.455 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.