COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK847718
Chemical Name: 5-[2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-ylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1O)C1CC(=C2C(=O)N(C)C(=O)N(C2=O)C)Nc2c(S1)cccc2

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Molecular Weight: 439.49
Empirical Formula: C22H21N3O5S

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 0.97
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 124
Number of rings: 4

     

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