COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK690927
Chemical Name: N-[2-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]cyclohexanecarboxamide
Smiles: COc1cc(CCNC2=C(C(=O)CC(C2)(C)C)C(C(F)(F)F)(C(F)(F)F)NC(=O)C2CCCCC2)ccc1OC

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Molecular Weight: 578.6
Empirical Formula: C28H36F6N2O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 10.258
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 76
Number of rings: 3

     

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