UCSF

ZINC00158307

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 Yes

Popular Name: ethyl 4-chloro-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxylate ethyl 4-chloro-1-methyl-2-oxo-1,…

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CAS Numbers: , 75483-04-4

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) 2.72 2.45 -12.83 0 4 0 48 265.696 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 98 - 100 KeyOrganics

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