UCSF

ZINC04384342

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 25th, 2005 12 Yes

Popular Name: Diethyl-piperidin-3-ylmethyl-amine Diethyl-piperidin-3-ylmethyl-amine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 100158-78-9 , 120990-84-3 , 1220021-29-3 , N/A , [1220021-29-3]

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) 1.30 5.82 -97.71 3 2 2 21 172.316 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 150 - 152 Enamine Building Blocks
MP 150...152 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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