COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219495
Chemical Name: methyl4-{2,5-dimethyl-3-[(E)-{2-[(2-methyl-1,3-dithiolan-2-yl)acetyl]hydrazinylidene}methyl]-1H-pyrrol-1-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=N/NC(=O)CC1(C)SCCS1

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Molecular Weight: 431.58
Empirical Formula: C21H25N3O3S2

Physical State: Dry powder
Available Amount: 318 mg

Lipinsky:
logP: 5.014
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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