COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK716291
Chemical Name: N-{(1Z)-1-[1-cyano-2-(cyclohexylamino)-2-oxoethylidene]-1H-isoindol-3-yl}-3,4,5-trimethoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cc(OC)c(c(c1)OC)OC)/C(=O)NC1CCCCC1

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Molecular Weight: 488.54
Empirical Formula: C27H28N4O5

Physical State: Dry powder
Available Amount: 414 mg

Lipinsky:
logP: 3.036
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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