COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK589699
Chemical Name: methyl2-{3-[(Z)-(1-cyclohexyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C\1/C(=NC(=O)N(C1=O)C1CCCCC1)O

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Molecular Weight: 509.63
Empirical Formula: C27H31N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.059
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 5

     

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