COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185124
Chemical Name: (2E)-N-(5-chloro-2-methylphenyl)-2-cyano-3-[1-(3-methylbenzyl)-1H-indol-3-yl]prop-2-enamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)Cc1cccc(c1)C)/C(=O)Nc1cc(Cl)ccc1C

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Molecular Weight: 439.94
Empirical Formula: C27H22ClN3O

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 7.242
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 57
Number of rings: 4

     

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