UCSF

ZINC13005271

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 24th, 2008 16 No

Popular Name: 4-(1-Methyl-1H-indol-3-yl)-thiazol-2-ylamine 4-(1-Methyl-1H-indol-3-yl)-thiaz…

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CAS Numbers: 189011-04-9 , [189011-04-9]

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) 2.37 6.39 -10.93 2 3 0 44 229.308 1 ↓

Vendor Notes

Note Type Comments Provided By
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.