COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK943049
Chemical Name: 3-methyl-4-{4-[(2-methylbenzyl)oxy]phenyl}-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2[nH]nc(c2C(SC1)c1ccc(cc1)OCc1ccccc1C)C

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Molecular Weight: 379.48
Empirical Formula: C21H21N3O2S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 3.824
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 95
Number of rings: 4

     

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