COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683271
Chemical Name: ethyl5-(acetyloxy)-6-bromo-2-{[4-(cyanomethyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-3-carboxylate
Smiles: N#CCN1CCN(CC1)Cc1n(C)c2c(c1C(=O)OCC)cc(c(c2)Br)OC(=O)C

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Molecular Weight: 477.36
Empirical Formula: C21H25BrN4O4

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 1.549
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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