COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK053899
Chemical Name: (19E)-4-propyl-2,16-didehydrocur-19-en-4-ium-17-al
Smiles: CCC[N+]12CCC34C2CC(/C(=C\C)/C1)C(=C3Nc1c4cccc1)C=O

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Saltdata: Cl -
Molecular Weight: 335.47
Empirical Formula: C22H27N2O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -1.513
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 29
Number of rings: 5

     

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