COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK556276
Chemical Name: (2E)-3-(3,4-dimethoxyphenyl)-N-[(9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl]prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)NC(=S)Nc2ccc3c(c2)C(=O)c2c(C3=O)cccc2)ccc1OC

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Molecular Weight: 472.52
Empirical Formula: C26H20N2O5S

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 4.788
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 125
Number of rings: 4

     

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