COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552774
Chemical Name: (19Z)-4-ethyl-12-hydroxy-2,16-didehydrocur-19-en-4-ium-17-al
Smiles: O=CC1=C2Nc3c([C@@]42C2CC1/C(=C/C)/C[N+]2(CC4)CC)cccc3O

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Saltdata: I-
Molecular Weight: 337.44
Empirical Formula: C21H25N2O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -2.007
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 49
Number of rings: 5

     

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