COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK930625
Chemical Name: N-[(2E)-3,4,5,6,7,8-hexahydro-2H-cyclohepta[d][1,3]thiazol-2-ylidene]-4-oxo-4-[4-(pyridin-2-yl)piperazin-1-yl]butanamide
Smiles: O=C(/N=c\1/sc2c([nH]1)CCCCC2)CCC(=O)N1CCN(CC1)c1ccccn1

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Molecular Weight: 413.54
Empirical Formula: C21H27N5O2S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.783
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 103
Number of rings: 4

     

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