UCSF

ZINC11902819

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2008 17 Yes

Popular Name: 6-(4-methoxyphenyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile 6-(4-methoxyphenyl)-2-oxo-1,2-di…

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CAS Numbers: 147269-06-5 , N/A

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) 2.02 4.66 -17.35 1 4 0 66 226.235 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 274 - 278 KeyOrganics

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