COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048772
Chemical Name: ethyl5-methoxy-1-methyl-3-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCN(CC2)c2ccc(cc2)[N+](=O)[O-])c2c(n1C)ccc(c2)OC

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Molecular Weight: 495.54
Empirical Formula: C25H29N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.57
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 121
Number of rings: 4

     

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