UCSF

ZINC00155993

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: 4-(4-Chlorobenzoyl)pyridine 4-(4-Chlorobenzoyl)pyridine

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CAS Number: 14548-48-2

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 2.78 0.89 -6.4 0 2 0 30 217.655 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 103 - 105 Enamine Building Blocks
MP 103...105 Enamine Building Blocks
Melting_Point 107-109? Alfa-Aesar
Melting_Point 107-109° Alfa-Aesar
MP 108 - 110 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.