COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182429
Chemical Name: (2E)-2-cyano-3-[1-(4-iodo-3-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-N-(naphthalen-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(c(c1)C)I)C)/C(=O)Nc1ccc2c(c1)cccc2

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Molecular Weight: 531.4
Empirical Formula: C27H22IN3O

Physical State: Dry powder
Available Amount: 475 mg

Lipinsky:
logP: 7.889
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 57
Number of rings: 4

     

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