COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044431
Chemical Name: (1Z)-4,4,6-trimethyl-2-oxo-1-(4-oxo-2-sulfanyl-1,3-thiazol-5(4H)-ylidene)-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-ylthiophene-2-carboxylate
Smiles: SC1=NC(=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: 300 mg

Lipinsky:
logP: 3.537
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 168
Number of rings: 5

     

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