UCSF

ZINC37594042

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2009 8 Yes

Popular Name: 5-Amino-4-chloropyrimidine 5-Amino-4-chloropyrimidine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 54660-78-5 , [54660-78-5]

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) 0.44 0.9 -5.25 2 3 0 52 129.55 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID WO2000047581A1 IBM Patent Data

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

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