COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK398646
Chemical Name: methyl4-(4-benzylpiperazin-1-yl)-3-{[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1ccc(c(c1)NC(=O)c1sc2c(c1Cl)ccc(c2)Cl)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 554.5
Empirical Formula: C28H25Cl2N3O3S

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 6.81
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 5

     

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