COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK597813
Chemical Name: 7'-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trio
Smiles: C=CCN1C(=NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)S

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Molecular Weight: 507.57
Empirical Formula: C25H25N5O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.504
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 149
Number of rings: 5

     

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