COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207389
Chemical Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(1-{[2-(1H-imidazol-4-yl)ethyl]amino}propylidene)-5-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC/C(=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)CSc1ccc(cc1)C)/NCCc1c[nH]cn1

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Molecular Weight: 502.66
Empirical Formula: C26H26N6OS2

Physical State: Dry powder
Available Amount: 43 mg

Lipinsky:
logP: 5.53
Rotatable bonds: 6
H-donors: 2
H-acceptors: 1
PSA: 139
Number of rings: 5

     

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