COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455181
Chemical Name: methyl5-(dimethylcarbamoyl)-4-methyl-2-[({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}carbonothioyl)amino]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)N2CCN(CC2)C/C=C/c2ccccc2)sc(c1C)C(=O)N(C)C

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Molecular Weight: 486.66
Empirical Formula: C24H30N4O3S2

Physical State: Dry powder
Available Amount: 447 mg

Lipinsky:
logP: 4.508
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 125
Number of rings: 3

     

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