UCSF

ZINC02458613

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2004 18 Yes

Popular Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carboxylic acid 5-(2,3-dihydro-1,4-benzodioxin-6…

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CAS Number: 790681-94-6

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) 2.84 -0.7 -53.74 0 4 -1 58 261.278 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 204 - 206 Enamine Building Blocks
MP 204...206 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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