COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK870138
Chemical Name: (2Z,4Z)-1,5-dicyano-3-(1-cyano-3-methoxy-3-oxopropyl)-1,5-bis(methoxycarbonyl)penta-2,4-dien-1-ide
Smiles: COC(=O)CC(/C(=C\[C-](C(=O)OC)C#N)/C=C(\C(=O)OC)/C#N)C#N

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Saltdata: (CH3)2NH2+
Molecular Weight: 344.3
Empirical Formula: C16H14N3O6

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 0.509
Rotatable bonds: 10
H-donors: 0
H-acceptors: 6
PSA: 150
Number of rings: 0

     

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