COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL312404
Chemical Name: ethyl[4-(1,5-dimethyl-1H-pyrazol-4-yl)-7-hydroxy-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]acetate
Smiles: CCOC(=O)Cn1nc(c2c1N=C(O)CSC2c1cnn(c1C)C)C

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Molecular Weight: 363.44
Empirical Formula: C16H21N5O3S

Physical State: Dry powder
Available Amount: 186 mg

Lipinsky:
logP: 0.684
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 119
Number of rings: 3

     

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