UCSF

ZINC15021880

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2008 9 Yes

Popular Name: 5-Bromo-4,6-dihydroxypyrimidine 5-Bromo-4,6-dihydroxypyrimidine

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CAS Numbers: 15726-38-2 , [15726-38-2]

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) 0.32 -1.39 -46.68 1 4 -1 69 189.976 0 ↓
Hi High (pH 8-9.5) 0.78 -2.6 -104.33 0 4 -2 72 188.968 0 ↓
Lo Low (pH 4.5-6) 0.32 -0.94 -41.12 2 4 0 70 190.984 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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