COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672904
Chemical Name: N-[(1E)-1-(1,3-benzodioxol-5-yl)-3-{[2-({(2Z)-3-(1,3-benzodioxol-5-yl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)ethyl]amino}-3-oxoprop-1-en-2-yl]benzamide
Smiles: O=C(/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)NCCNC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1

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Molecular Weight: 646.66
Empirical Formula: C36H30N4O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.759
Rotatable bonds: 7
H-donors: 4
H-acceptors: 8
PSA: 153
Number of rings: 6

     

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