COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL175653
Chemical Name: (2E,6E)-2,6-bis[4-(pentyloxy)benzylidene]cyclohexanone
Smiles: CCCCCOc1ccc(cc1)/C=C/1\CCC/C(=C\c2ccc(cc2)OCCCCC)/C1=O

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Molecular Weight: 446.63
Empirical Formula: C30H38O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 10.156
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 3

     

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