COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560111
Chemical Name: 1-(2-{6-[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-1,3-dimethylthiourea
Smiles: CNC(=S)N(CCc1cc2OCOc2c(c1/C=C/1\C(=NC(=NC1=O)O)O)OC)C

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Molecular Weight: 420.45
Empirical Formula: C18H20N4O6S

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 1.169
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 157
Number of rings: 3

     

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