COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK036848
Chemical Name: N-(4-acetylphenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]butanamide
Smiles: CCC(C(=O)Nc1ccc(cc1)C(=O)C)Sc1nc2c(s1)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 415.49
Empirical Formula: C19H17N3O4S2

Physical State: Dry powder
Available Amount: 199 mg

Lipinsky:
logP: 4.871
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 158
Number of rings: 3

     

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