UCSF

ZINC01384961

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 13 Yes

Popular Name: 4-chloro-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile 4-chloro-2-(dimethylamino)-6-oxo…

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CAS Number: 132164-86-4

Other Names:

MFCD00171918

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) 0.69 3.25 -10.82 0 5 0 70 199.597 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 170 - 173 KeyOrganics

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Rings

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

No pre-computed analogs available. Try a structural similarity search.