UCSF

ZINC05327776

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2006 14 Yes

Popular Name: 1-(1-adamantyl)propan-2-amine 1-(1-adamantyl)propan-2-amine

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CAS Numbers: 39978-69-3 , [39978-69-3]

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) 2.73 -1.49 -42.92 3 1 1 27 194.342 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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