COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK773233
Chemical Name: 1-(2-chlorophenyl)-3-[3-({[(2-chlorophenyl)carbamothioyl]amino}methyl)-3,5,5-trimethylcyclohexyl]thiourea
Smiles: S=C(Nc1ccccc1Cl)NCC1(C)CC(NC(=S)Nc2ccccc2Cl)CC(C1)(C)C

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Molecular Weight: 509.57
Empirical Formula: C24H30Cl2N4S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.801
Rotatable bonds: 3
H-donors: 4
H-acceptors: 0
PSA: 112
Number of rings: 3

     

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