COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK125761
Chemical Name: methyl4-{3-[(Z)-(1-ethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Smiles: CCN1C(=S)NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)C(=O)OC)C)/C1=O

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Molecular Weight: 411.48
Empirical Formula: C21H21N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.795
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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