UCSF

ZINC00392351

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2005 15 Yes

Popular Name: (1-adamantyloxy)acetic acid (1-adamantyloxy)acetic acid

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CAS Numbers: , 1614-38-6

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) 2.47 -0.24 -49.2 0 3 -1 49 209.265 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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