COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK905915
Chemical Name: 5-(4-benzylpiperidin-1-yl)-2-{(E)-[3-(furan-2-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCC(CC1)Cc1ccccc1)/C=C\1/SC(=S)N(C1=O)Cc1ccco1

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Saltdata: 1/2 CH3COOH
Molecular Weight: 490.61
Empirical Formula: C25H22N4O3S2

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 3.061
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 143
Number of rings: 5

     

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