COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527562
Chemical Name: N'-[(3E)-1-(azepan-1-ylmethyl)-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-(1,3-benzothiazol-2-ylsulfanyl)acetohydrazide
Smiles: O=C(N/N=C/1\c2cc(Br)ccc2N(C1=O)CN1CCCCCC1)CSc1nc2c(s1)cccc2

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Molecular Weight: 558.52
Empirical Formula: C24H24BrN5O2S2

Physical State: Dry powder
Available Amount: 273 mg

Lipinsky:
logP: 6.183
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 131
Number of rings: 5

     

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