UCSF

ZINC03750721

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2004 14 Yes

Popular Name: 2-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)acetic acid 2-(2,3-Dihydrobenzo[b][1,4]dioxi…

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CAS Numbers: 17253-11-1 , [17253-11-1]

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) 0.87 4.08 -49.23 0 4 -1 59 193.178 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 54 - 56 Enamine Building Blocks
MP 54...56 Enamine Building Blocks
MP 76° Matrix Scientific
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% )