COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527167
Chemical Name: 2,7-bis(azepan-1-ylmethyl)-1,8-bis(4-methoxyphenyl)octane-1,8-dione
Smiles: COc1ccc(cc1)C(=O)C(CN1CCCCCC1)CCCCC(C(=O)c1ccc(cc1)OC)CN1CCCCCC1

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Saltdata: 2 HCl
Molecular Weight: 576.82
Empirical Formula: C36H52N2O4

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 8.288
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 59
Number of rings: 4

     

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