COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK336901
Chemical Name: (2E)-3-(3,5-dichloro-2-methoxyphenyl)-N-{4-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]phenyl}prop-2-enamide
Smiles: COc1c(/C=C/C(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2cccs2)cc(cc1Cl)Cl

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Molecular Weight: 516.45
Empirical Formula: C25H23Cl2N3O3S

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 4.738
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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