COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527855
Chemical Name: (5Z)-1-(4-chlorophenyl)-5-({[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1c2c(CCN(C2CN/C=C\2/C(=O)NC(=S)N(C2=O)c2ccc(cc2)Cl)C)cc2c1OCO2

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Molecular Weight: 514.99
Empirical Formula: C24H23ClN4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.334
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 124
Number of rings: 5

     

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