UCSF

ZINC06117490

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2006 13 Yes

Popular Name: 3,4-dihydro-2H-1-benzopyran-4-carboxylic acid 3,4-dihydro-2H-1-benzopyran-4-ca…

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CAS Number: 20426-80-6

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) 1.29 0.49 -48.15 0 3 -1 49 177.179 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 87 - 89 Enamine Building Blocks
MP 87...89 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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