COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK594360
Chemical Name: (5Z)-6-hydroxy-5-[2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-ylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C/2\CC(Sc3c(N2)cccc3)c2ccc(cc2)OC)/C1=O)O

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Molecular Weight: 467.55
Empirical Formula: C24H25N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.392
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 125
Number of rings: 4

     

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