UCSF

ZINC11953301

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2008 18 Yes

Popular Name: 4-(4-benzylpiperidin-1-yl)butan-1-amine 4-(4-benzylpiperidin-1-yl)butan-…

Find On: PubMed — Wikipedia — Google

CAS Number: 753431-65-1

Other Names:

MFCD09723575

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) 2.27 -1.19 -98.13 4 2 2 32 248.414 6 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP0915888A1; WO1997040051A1 IBM Patent Data

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