UCSF

ZINC08733358

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 28 No

Popular Name: 4-[3-(4-methoxyphenyl)-3-oxo-1-propenyl]phenyl 4-methylbenzenecarboxylate 4-[3-(4-methoxyphenyl)-3-oxo-1-p…

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CAS Number: 331461-43-9

Other Names:

MFCD00169657

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) 6.18 4.23 -15.67 0 4 0 52 372.42 7 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 172 - 173 KeyOrganics

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