COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK004710
Chemical Name: N-(2-{[2-(naphthalen-2-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-nitrobenzamide
Smiles: O=C(c1ccc2c(c1)cccc2)CSc1sc2c(n1)ccc(c2)NC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 499.57
Empirical Formula: C26H17N3O4S2

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 6.272
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 158
Number of rings: 5

     

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