COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565417
Chemical Name: 1,1'-{(1E,2E)-hydrazine-1,2-diylidenebis[(E)methylylidene(7-methoxy-1,3-benzodioxole-6,5-diyl)ethane-2,1-diyl]}bis[3-butan-2-yl-1-methyl(thiourea)]
Smiles: CCC(NC(=S)N(CCc1cc2OCOc2c(c1/C=N/N=C/c1c(CCN(C(=S)NC(CC)C)C)cc2c(c1OC)OCO2)OC)C)C

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Molecular Weight: 700.92
Empirical Formula: C34H48N6O6S2

Physical State: Liquid
Available Amount: 10 mg

Lipinsky:
logP: 4.87
Rotatable bonds: 14
H-donors: 2
H-acceptors: 6
PSA: 174
Number of rings: 4

     

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