COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK036416
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-({[2-(morpholin-4-yl)ethyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C/NCCN1CCOCC1)c1nc2c(s1)cccc2

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Molecular Weight: 514.07
Empirical Formula: C24H24ClN5O2S2

Physical State: Dry powder
Available Amount: 366 mg

Lipinsky:
logP: 4.958
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 123
Number of rings: 5

     

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