COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525109
Chemical Name: (5-benzyl-5H-1-thia-3,4,5,8-tetraazaacenaphthylen-2-yl)(4-nitrophenyl)methanone
Smiles: O=C(c1sc2c3c1nnn(c3ccn2)Cc1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 415.43
Empirical Formula: C21H13N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.814
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 131
Number of rings: 5

     

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