COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK684238
Chemical Name: 2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(E)-{[2-(1H-imidazol-4-yl)ethyl]imino}methyl]-1,2-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)SCc1[nH]n(c(=O)c1/C=N/CCc1c[nH]cn1)c1nc2c(s1)cccc2

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Molecular Weight: 495.03
Empirical Formula: C23H19ClN6OS2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.92
Rotatable bonds: 6
H-donors: 2
H-acceptors: 1
PSA: 139
Number of rings: 5

     

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