UCSF

ZINC01570699

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 12 Yes

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

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CAS Number: 380190-11-4

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) 1.42 4.66 -9.83 1 2 0 36 164.183 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 38 - 42 Enamine Building Blocks
MP 39 - 41 Enamine Building Blocks
MP 39...41 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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