COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL447192
Chemical Name: 1-(4-methylphenyl)-4,10a-diphenyl-5,10a-dihydro-1H-pyrrolo[2,3-b][1,5]benzothiazepine-2,3-dione
Smiles: Cc1ccc(cc1)N1C(=O)C(=O)C2=C(Nc3c(SC12c1ccccc1)cccc3)c1ccccc1

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Molecular Weight: 474.58
Empirical Formula: C30H22N2O2S

Physical State: Dry powder
Available Amount: 342 mg

Lipinsky:
logP: 6.992
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 74
Number of rings: 6

     

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