UCSF

ZINC02628571

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2004 14 Yes

Popular Name: 5-[4-(propan-2-yl)phenyl]-1H-1,2,3,4-tetrazole 5-[4-(propan-2-yl)phenyl]-1H-1,2…

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CAS Number: 460363-75-1

Other Names:

MFCD03069379

MFCD06347920

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) 2.88 4.8 -39.94 0 4 -1 53 187.226 2 ↓
Lo Low (pH 4.5-6) 2.88 4.88 -7.13 1 4 0 54 188.234 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 186 - 188 Enamine Building Blocks
MP 186...188 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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