COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK397653
Chemical Name: N-{[2-(butanoylamino)-1,3-benzothiazol-6-yl]carbamothioyl}-2-(morpholin-4-yl)-5-nitrobenzamide
Smiles: CCCC(=O)Nc1nc2c(s1)cc(cc2)NC(=S)NC(=O)c1cc(ccc1N1CCOCC1)[N+](=O)[O-]

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Molecular Weight: 528.61
Empirical Formula: C23H24N6O5S2

Physical State: Dry powder
Available Amount: 153 mg

Lipinsky:
logP: 3.274
Rotatable bonds: 3
H-donors: 3
H-acceptors: 5
PSA: 201
Number of rings: 4

     

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