COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL240970
Chemical Name: 3-hydroxy-1-(propan-2-yl)-4-[4-(prop-2-en-1-yloxy)phenyl]-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: C=CCOc1ccc(cc1)C1SCC(=O)Nc2c1c(O)nn2C(C)C

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Molecular Weight: 359.45
Empirical Formula: C18H21N3O3S

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 3.993
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 101
Number of rings: 3

     

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