COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK023838
Chemical Name: ethyl2-{3-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)C=C1C(=O)N(C)C(=O)N(C1=O)C

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Molecular Weight: 469.56
Empirical Formula: C24H27N3O5S

Physical State: Dry powder
Available Amount: 1297 mg

Lipinsky:
logP: 4.282
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 117
Number of rings: 4

     

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