UCSF

ZINC02584879

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 16 No

Popular Name: 2-Amino-4-(3,4-dichlorophenyl)thiophene-3-carbonitrile 2-Amino-4-(3,4-dichlorophenyl)th…

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CAS Numbers: 861407-95-6 , [861407-95-6]

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) 3.89 -0.1 -7.39 2 2 0 49 269.156 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 90% Fluorochem
Warnings IRRITANT Matrix Scientific

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