COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK261952
Chemical Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(1-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}ethylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc2c(c1)c(CCN/C(=C\1/C(=NN(C1=O)c1nc3c(s1)cccc3)C)/C)c[nH]2

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Molecular Weight: 449.96
Empirical Formula: C23H20ClN5OS

Physical State: Dry powder
Available Amount: 421 mg

Lipinsky:
logP: 5.141
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 101
Number of rings: 5

     

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