COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK246042
Chemical Name: 4-chloro-N-{2-[5-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Smiles: C=CCn1c(CCNC(=O)c2ccc(cc2)Cl)nnc1SCC(=O)N1CCCc2c1cccc2

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Molecular Weight: 496.03
Empirical Formula: C25H26ClN5O2S

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 5.415
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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