COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL319463
Chemical Name: 4-[7-hydroxy-4-(4-methoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoicacid
Smiles: COc1ccc(cc1)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O

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Molecular Weight: 395.44
Empirical Formula: C20H17N3O4S

Physical State: Dry powder
Available Amount: 322 mg

Lipinsky:
logP: 2.723
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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