UCSF

ZINC01403907

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 23 Yes

Popular Name: 4-(2,4-dichlorophenyl)-5-(methoxycarbonyl)-2,6-dimethyl-1,4-dihydro-3-pyridinecarboxylic acid 4-(2,4-dichlorophenyl)-5-(methox…

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CAS Number: 439120-57-7

Other Names:

MFCD03012353

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) 3.83 8.11 -49.63 1 5 -1 78 355.197 4 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 155 - 156 KeyOrganics

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