COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL000777
Chemical Name: 2,5-bis(1H-benzotriazol-1-yl)-3,6-bis[(4-bromophenyl)amino]cyclohexa-2,5-diene-1,4-dione
Smiles: Brc1ccc(cc1)NC1=C(C(=O)C(=C(C1=O)n1nnc2c1cccc2)Nc1ccc(cc1)Br)n1nnc2c1cccc2

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Molecular Weight: 682.33
Empirical Formula: C30H18Br2N8O2

Available Amount: 0 mg

Lipinsky:
logP: 6.027
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 119
Number of rings: 7

     

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