COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL513633
Chemical Name: (8Z,8'Z)-8,8'-bis{[(4-acetylphenyl)amino]methylidene}-1,1',6,6'-tetrahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)-2,2'-binaphthalene-7,7'(8H,8'H)-dione
Smiles: CC(C1=C(O)C(=O)/C(=C\Nc2ccc(cc2)C(=O)C)/c2c1cc(C)c(c2O)c1c(C)cc2c(c1O)/C(=C/Nc1ccc(cc1)C(=O)C)/C(=O)C(=C2C(C)C)O)C

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Molecular Weight: 752.86
Empirical Formula: C46H44N2O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 11.361
Rotatable bonds: 7
H-donors: 6
H-acceptors: 8
PSA: 173
Number of rings: 6

     

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