UCSF

ZINC03848335

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 13 Yes

Popular Name: 5,6,7,8-Tetrahydronaphthalene-1-carboxylic acid 5,6,7,8-Tetrahydronaphthalene-1-…

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CAS Numbers: 1914-65-4 , 4242-18-6 , 86-55-5 , [4242-18-6]

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) 2.67 0.59 -53.71 0 2 -1 40 175.207 1 ↓

Vendor Notes

Note Type Comments Provided By
mp 147 - 150 MolMall (formerly Molecular Diversity Preservation International)
MP 152 TCI
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

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