COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK081954
Chemical Name: N-{[5-(methoxycarbonyl)furan-2-yl]methyl}-N-(prop-2-en-1-yl)prop-2-en-1-aminium
Smiles: COC(=O)c1ccc(o1)C[NH+](CC=C)CC=C

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Saltdata: Cl-
Molecular Weight: 236.29
Empirical Formula: C13H18NO3

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 2.865
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 43
Number of rings: 1

     

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