COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK773303
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-(1-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}propylidene)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1)/NCCc1c(C)[nH]c2c1cccc2

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Molecular Weight: 505.64
Empirical Formula: C30H27N5OS

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.1
Rotatable bonds: 4
H-donors: 2
H-acceptors: 1
PSA: 101
Number of rings: 6

     

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