UCSF

ZINC32627181

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 6th, 2009 21 Yes

Popular Name: ethyl 1-(3-aminophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate ethyl 1-(3-aminophenyl)-5-(trifl…

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CAS Number: 1171543-02-4

Other Names:

MFCD11099491

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) 2.19 5.59 -9.66 2 5 0 70 299.252 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 87 - 89 Enamine Building Blocks
MP 87...89 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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