COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541333
Chemical Name: 2,5-bis[(ethylamino)methyl]-1,6-bis(4-propoxyphenyl)hexane-1,6-dione
Smiles: CCNCC(C(=O)c1ccc(cc1)OCCC)CCC(C(=O)c1ccc(cc1)OCCC)CNCC

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Saltdata: 2 HCl
Molecular Weight: 496.69
Empirical Formula: C30H44N2O4

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 6.026
Rotatable bonds: 15
H-donors: 2
H-acceptors: 4
PSA: 76
Number of rings: 2

     

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