COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK035885
Chemical Name: (2E,6E)-2,6-bis[(2E,4E)-5-(dimethylamino)penta-2,4-dien-1-ylidene]cyclohexanone
Smiles: CN(/C=C/C=C/C=C/1\CCC/C(=C\C=C\C=C\N(C)C)/C1=O)C

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Saltdata: HCl
Molecular Weight: 312.46
Empirical Formula: C20H28N2O

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 3.271
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 23
Number of rings: 1

     

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