COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK129545
Chemical Name: (1Z)-4,4,6-trimethyl-2-oxo-1-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-ylthiophene-2-carboxylate
Smiles: S=C1NC(=O)/C(=C/2\c3cc(cc4c3N(C2=O)C(C)(C)C=C4C)OC(=O)c2cccs2)/S1

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Molecular Weight: 468.58
Empirical Formula: C22H16N2O4S3

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 1.896
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 161
Number of rings: 5

     

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