COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL447119
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C/NCCCn1cncc1)c1nc2c(s1)cccc2

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Molecular Weight: 509.06
Empirical Formula: C24H21ClN6OS2

Physical State: Dry powder
Available Amount: 396 mg

Lipinsky:
logP: 5.296
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 128
Number of rings: 5

     

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