COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK513030
Chemical Name: 1-(5-{5-chloro-2-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-4-[4-(pyrrolidin-1-yl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl)ethanone
Smiles: Clc1ccc(c(c1)C1N(N=C(N1c1ccc(cc1)N1CCCC1)C(=O)C)c1ccccc1)OCc1ccccc1Cl

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Molecular Weight: 585.53
Empirical Formula: C33H30Cl2N4O2

Physical State: Dry powder
Available Amount: 224 mg

Lipinsky:
logP: 6.706
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 48
Number of rings: 6

     

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