COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526231
Chemical Name: 1,8-bis[4-(pentyloxy)phenyl]-2,7-bis(piperidin-1-ylmethyl)octane-1,8-dione
Smiles: CCCCCOc1ccc(cc1)C(=O)C(CN1CCCCC1)CCCCC(C(=O)c1ccc(cc1)OCCCCC)CN1CCCCC1

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Saltdata: 2 HCl
Molecular Weight: 660.98
Empirical Formula: C42H64N2O4

Physical State: Dry powder
Available Amount: 297 mg

Lipinsky:
logP: 11.411
Rotatable bonds: 17
H-donors: 0
H-acceptors: 4
PSA: 59
Number of rings: 4

     

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