In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 14 | No |
Popular Name: 3-Pyridin-4-yl-benzaldehyde 3-Pyridin-4-yl-benzaldehyde
Find On: PubMed — Wikipedia — Google
CAS Numbers: 208190-04-9 , [208190-04-9]
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) | 2.21 | 1.36 | -8.96 | 0 | 2 | 0 | 30 | 183.21 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.21 | 1.47 | -42 | 1 | 2 | 1 | 31 | 184.218 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Purity | 95+% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.