COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK630315
Chemical Name: (5Z)-5-[2-(2-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-ylidene]-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1C1C/C(=C/2\C(=O)N=C(N(C2=O)C)S)/Nc2c(S1)cccc2

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Molecular Weight: 425.53
Empirical Formula: C21H19N3O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.203
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 135
Number of rings: 4

     

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