UCSF

ZINC34320135

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 14 Yes

Popular Name: (3-Methyl-piperidin-4-yl)-phenyl-amine (3-Methyl-piperidin-4-yl)-phenyl…

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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) 2.76 5.32 -41.23 3 2 1 29 191.298 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0383579A1; EP0383579B1; US5019583 IBM Patent Data

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