UCSF

ZINC04207146

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 8 Yes

Popular Name: 2-(Tetrahydrofuran-2-yl)acetonitrile 2-(Tetrahydrofuran-2-yl)acetonit…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 33414-62-9 , [33414-62-9]

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) 0.14 2.93 -8.68 0 2 0 33 111.144 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 263 - 265 Enamine Building Blocks
MP 263...265 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks
BP 92 / 13 TCI
purity 95 Enamine Building Blocks
Purity 95% Fluorochem

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