COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK789621
Chemical Name: 3-({2-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-2-oxoethyl}sulfanyl)-6,6-dimethyl-1,6-dihydro-1,2,4-triazin-5(4H)-one
Smiles: Clc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cccc2)C(=O)CSC1=NNC(C(=O)N1)(C)C

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Molecular Weight: 485.05
Empirical Formula: C25H29ClN4O2S

Physical State: Dry powder
Available Amount: 321 mg

Lipinsky:
logP: 6.453
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 99
Number of rings: 4

     

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