COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK510968
Chemical Name: 1-{1-(3,4-dichlorophenyl)-5-(1H-indol-3-yl)-4-[4-(morpholin-4-ylmethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone
Smiles: CC(=O)C1=NN(C(N1c1ccc(cc1)CN1CCOCC1)c1c[nH]c2c1cccc2)c1ccc(c(c1)Cl)Cl

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Molecular Weight: 548.47
Empirical Formula: C29H27Cl2N5O2

Physical State: Dry powder
Available Amount: 227 mg

Lipinsky:
logP: 3.604
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 64
Number of rings: 6

     

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