COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK776065
Chemical Name: ethyl6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc3c(s2)cccc3)NC(=O)NC1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 470.53
Empirical Formula: C21H18N4O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.125
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 179
Number of rings: 4

     

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