COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382640
Chemical Name: 4-(7-tert-butyl-4-oxo-1,2,3,4,5,6,7,8-octahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl1,3-benzodioxole-5-carboxylate
Smiles: COc1cc(ccc1OC(=O)c1ccc2c(c1)OCO2)C1NC(=O)c2c(N1)sc1c2CCC(C1)C(C)(C)C

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Molecular Weight: 534.63
Empirical Formula: C29H30N2O6S

Physical State: Dry powder
Available Amount: 605 mg

Lipinsky:
logP: 5.238
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 123
Number of rings: 6

     

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