UCSF

ZINC35322833

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 13 Yes

Popular Name: 3-BOC-AMINOBUTYRONITRILE 3-BOC-AMINOBUTYRONITRILE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 170367-68-7 , 194156-55-3

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) 2.72 3.37 -12.47 1 4 0 62 184.239 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID US5637613 IBM Patent Data

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