UCSF

ZINC11730668

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2008 18 Yes

Popular Name: 1-(4-bromophenyl)-5-cyclopropyl-1H-1,2,3-triazole-4-carboxylic acid 1-(4-bromophenyl)-5-cyclopropyl-…

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CAS Number: 1017445-41-8

Other Names:

MFCD10006662

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) 2.34 0.39 -52.55 0 5 -1 71 307.127 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 176 - 178 Enamine Building Blocks
MP 176...178 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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