UCSF

ZINC05105922

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 21st, 2006 16 Yes

Popular Name: [(2,3-Dihydro-benzo[1,4]dioxin-6-ylmethyl)-amino]-acetic acid [(2,3-Dihydro-benzo[1,4]dioxin-6…

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CAS Numbers: 31127-41-0 , 721386-07-8

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) -0.66 3.63 -44.11 2 5 0 75 223.228 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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