COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK513912
Chemical Name: 3-[(E)-(2-{(2Z)-3-[4-(dimethylamino)phenyl]-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)methyl]phenyl1,3-benzodioxole-5-carboxylate
Smiles: CN(c1ccc(cc1)/C=C(/C(=O)N/N=C/c1cccc(c1)OC(=O)c1ccc2c(c1)OCO2)\NC(=O)c1ccccc1)C

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Molecular Weight: 576.61
Empirical Formula: C33H28N4O6

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 6.676
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 118
Number of rings: 5

     

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