UCSF

ZINC01390192

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 25 No

Popular Name: methyl 2-(4-chlorophenyl)-3-(4-methylbenzoyl)-1,3-thiazolane-4-carboxylate methyl 2-(4-chlorophenyl)-3-(4-m…

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CAS Number: 477768-31-3

Other Names:

MFCD02571122

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) 3.84 1.73 -10.41 0 4 0 46 375.877 4 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 46 - 49 KeyOrganics

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