COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK674746
Chemical Name: 2-{[6-({(E)-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrophenyl]methylidene}amino)-1,3-benzothiazol-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Smiles: O=C(CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(c(c1)[N+](=O)[O-])Sc1nc2c(s1)cccc2)NCCc1ccccc1

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Molecular Weight: 641.82
Empirical Formula: C31H23N5O3S4

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 8.268
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 220
Number of rings: 6

     

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