UCSF

ZINC00563157

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 17 No

Popular Name: 3-[(3-Chlorophenyl)amino]-5,5-dimethylcyclohex-2-en-1-one 3-[(3-Chlorophenyl)amino]-5,5-di…

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CAS Numbers: , 50685-29-5

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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) 3.81 0.98 -7.29 1 2 0 29 249.741 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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