UCSF

ZINC19735633

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 11 Yes

Popular Name: (1-Isopropyl-piperidin-4-yl)-methyl-amine (1-Isopropyl-piperidin-4-yl)-met…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 503126-34-9 , 790205-01-5 , [503126-34-9]

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) 1.19 2.5 -36.9 2 2 1 20 157.281 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID WO2000039111A1; WO2000039117A1 IBM Patent Data

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