UCSF

ZINC02750216

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 21 Yes

Popular Name: 6-{[(3-Acetylphenyl)amino]carbonyl}cyclohex-3-ene-1-carboxylic acid 6-{[(3-Acetylphenyl)amino]carbon…

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CAS Numbers: , 194801-16-6

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) 1.90 0.56 -73.8 1 5 -1 86 286.307 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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