COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148508
Chemical Name: ethyl2-(3-{(E)-[2-hydroxy-1-(4-methylphenyl)-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-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=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)C)O

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Molecular Weight: 531.63
Empirical Formula: C29H29N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.743
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 5

     

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