COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512632
Chemical Name: (8Z,8'Z)-8,8'-bis{[(2,5-dimethoxyphenyl)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: COc1ccc(cc1N/C=C/1\C(=O)C(=C(c2c1c(O)c(c(c2)C)c1c(C)cc2c(c1O)/C(=C/Nc1cc(OC)ccc1OC)/C(=O)C(=C2C(C)C)O)C(C)C)O)OC

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Molecular Weight: 788.89
Empirical Formula: C46H48N2O10

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 12.015
Rotatable bonds: 11
H-donors: 6
H-acceptors: 10
PSA: 176
Number of rings: 6

     

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