COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL237614
Chemical Name: methyl4-({methyl[(4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-5-yl)methyl]carbamothioyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=S)N(Cc1cc2cccc3c2n(c1=O)CC3)C

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Molecular Weight: 407.49
Empirical Formula: C22H21N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.231
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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