UCSF

ZINC08699129

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2007 12 Yes

Popular Name: 1-isopropylpiperidine-3-carboxylic acid 1-isopropylpiperidine-3-carboxyl…

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CAS Numbers: 50678-87-0 , 762180-94-9 , [50678-87-0]

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) 1.03 5.49 -49.33 1 3 0 45 171.24 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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