COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK520090
Chemical Name: methyl2-{[(3-chloro-7-nitro-1-benzothiophen-2-yl)carbonyl]amino}-1,3-benzothiazole-6-carboxylate
Smiles: COC(=O)c1ccc2c(c1)sc(n2)NC(=O)c1sc2c(c1Cl)cccc2[N+](=O)[O-]

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Molecular Weight: 447.88
Empirical Formula: C18H10ClN3O5S2

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 5.563
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 170
Number of rings: 4

     

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