UCSF

ZINC01390594

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 17 No

Popular Name: 4-[(3-methyl-2,4-dioxo-1,3-thiazolan-5-yl)methyl]benzenecarbonitrile 4-[(3-methyl-2,4-dioxo-1,3-thiaz…

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CAS Number: 866019-15-0

Other Names:

MFCD03787142

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) 1.46 6.08 -9.89 0 4 0 61 246.291 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 124 - 126 KeyOrganics

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