COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL162514
Chemical Name: 4-(7-hydroxy-1,3-dimethyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl)benzoicacid
Smiles: OC1=Nc2n(C)nc(c2C(SC1)c1ccc(cc1)C(=O)O)C

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Molecular Weight: 317.37
Empirical Formula: C15H15N3O3S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 1.319
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 113
Number of rings: 3

     

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