UCSF

ZINC03148984

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 14 Yes

Popular Name: 3-(4-Ethoxy-phenylamino)-propionitrile 3-(4-Ethoxy-phenylamino)-propion…

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CAS Number: 23609-20-3

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) 1.69 4.81 -9.92 1 3 0 45 190.246 5 ↓

Vendor Notes

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

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