COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL312740
Chemical Name: ethyl[7-hydroxy-3-methyl-4-(quinolin-8-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]acetate
Smiles: CCOC(=O)Cn1nc(c2c1N=C(O)CSC2c1cccc2c1nccc2)C

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Molecular Weight: 396.47
Empirical Formula: C20H20N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.14
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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