COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL492237
Chemical Name: 4-(2-ethoxyphenyl)-1-(pentan-2-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
Smiles: CCCC(n1[nH]c(=O)c2c1NC(=O)CSC2c1ccccc1OCC)C

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Molecular Weight: 375.49
Empirical Formula: C19H25N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.714
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 95
Number of rings: 3

     

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