COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383837
Chemical Name: 4-[4-hydroxy-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]phenyl1,3-benzodioxole-5-carboxylate
Smiles: CCC(C1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(cc1)OC(=O)c1ccc2c(c1)OCO2)O)(C)C

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Molecular Weight: 518.63
Empirical Formula: C29H30N2O5S

Physical State: Dry powder
Available Amount: 415 mg

Lipinsky:
logP: 6.072
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 117
Number of rings: 6

     

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