UCSF

ZINC02001818

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 14 No

Popular Name: 7-Methoxy-2H-chromene-3-carbaldehyde 7-Methoxy-2H-chromene-3-carbalde…

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CAS Numbers: 57543-39-2 , [57543-39-2]

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) 2.15 1.16 -11.26 0 3 0 36 190.198 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 82 - 84 Enamine Building Blocks
MP 82...84 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
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.