COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382124
Chemical Name: methyl4-(7-tert-butyl-4-oxo-1,2,3,4,5,6,7,8-octahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1NC(=O)c2c(N1)sc1c2CCC(C1)C(C)(C)C

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Molecular Weight: 398.53
Empirical Formula: C22H26N2O3S

Physical State: Dry powder
Available Amount: 536 mg

Lipinsky:
logP: 4.504
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 95
Number of rings: 4

     

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