In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 18 | Yes |
Popular Name: 3-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)benzonitrile 3-chloro-4-(6,8-dihydro-5H-imida…
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) | 1.82 | 8.9 | -35.64 | 1 | 4 | 1 | 46 | 259.72 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.82 | 8.43 | -9.68 | 0 | 4 | 0 | 45 | 258.712 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.