UCSF

ZINC04992676

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 14th, 2006 12 Yes

Popular Name: (2,3-Dihydro-benzo[1,4]dioxin-6-yl)-methyl-amine (2,3-Dihydro-benzo[1,4]dioxin-6-…

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CAS Numbers: 17413-10-4 , 90609-93-1 , 90609-94-2

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) 1.30 2.43 -6.03 1 3 0 30 165.192 1 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )