UCSF

ZINC06678391

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2006 15 No

Popular Name: 4-(3-Methyl-piperidin-1-yl)-benzaldehyde 4-(3-Methyl-piperidin-1-yl)-benz…

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CAS Numbers: 1185153-16-5 , 869943-29-3 , N/A

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) 2.98 -0.08 -5.88 0 2 0 20 203.285 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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