COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL237809
Chemical Name: 1-(butan-2-yl)-3-hydroxy-4-(4-methoxyphenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: CCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)OC)O)C

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Molecular Weight: 347.44
Empirical Formula: C17H21N3O3S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 3.719
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 101
Number of rings: 3

     

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