COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK538371
Chemical Name: 3-{(1Z)-1-[(2Z)-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)hydrazinylidene]ethyl}-4-hydroxy-6-methyl-2H-pyran-2-one
Smiles: Cc1cc(O)c(c(=O)o1)/C(=N\N=C\1/NC(C)(C)Cc2c1cccc2)/C

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Molecular Weight: 339.39
Empirical Formula: C19H21N3O3

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 3.178
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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