COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK676033
Chemical Name: 1-[6-tert-butyl-4-(4-chlorophenyl)-1,3,3-tricyano-3,4,4a,5,6,7-hexahydronaphthalen-2-yl]-3-(4-chlorophenyl)urea
Smiles: N#CC1=C(NC(=O)Nc2ccc(cc2)Cl)C(C(C2C1=CCC(C2)C(C)(C)C)c1ccc(cc1)Cl)(C#N)C#N

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Molecular Weight: 544.48
Empirical Formula: C30H27Cl2N5O

Available Amount: 0 mg

Lipinsky:
logP: 8.353
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 112
Number of rings: 4

     

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