UCSF

ZINC01078933

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 11 No

Popular Name: 4,6-Dichloro-5-nitropyrimidine 4,6-Dichloro-5-nitropyrimidine

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CAS Numbers: 4316-93-2 , 850375-14-3 , [4316-93-2]

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 1.72 4.21 -4.37 0 5 0 72 193.977 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 100 - 103 Enamine Building Blocks
Melting_Point 100-103? Alfa-Aesar
MP 100-103° Oakwood Chemical
MP 100...103 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

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

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