UCSF

ZINC40448100

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 13 Yes

Popular Name: 1-(3-Methoxyphenyl)cyclopropanecarbonitrile 1-(3-Methoxyphenyl)cyclopropanec…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 74205-01-9 , [74205-01-9]

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) 2.17 6 -9.53 0 2 0 33 173.215 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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