UCSF

ZINC00365913

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

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

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CAS Numbers: 88958-14-9 , [88958-14-9]

Other Names:

MFCD02168480

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) 2.03 1.21 -53.84 0 5 -1 70 236.638 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 179 - 181 Enamine Building Blocks
MP 179...181 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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