In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2009 | 14 | 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) | 0.70 | 2.06 | -34.88 | 3 | 3 | 1 | 37 | 199.318 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 0.89 | -33.32 | 3 | 3 | 1 | 40 | 199.318 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 3.14 | -97.43 | 4 | 3 | 2 | 41 | 200.326 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.