COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK589435
Chemical Name: N-tert-butyl-2-{[3-cyano-5-hydroxy-4-(4-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)NC(C)(C)C)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)OC

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Molecular Weight: 453.61
Empirical Formula: C25H31N3O3S

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 4.881
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 120
Number of rings: 3

     

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