COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371823
Chemical Name: 1-[(2E)-3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}-2-cyanoprop-2-enoyl]piperidine-4-carboxamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)CCOc1ccc(c(c1)C)Cl)/C(=O)N1CCC(CC1)C(=O)N

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Molecular Weight: 490.99
Empirical Formula: C27H27ClN4O3

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 3.715
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 101
Number of rings: 4

     

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