COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK466990
Chemical Name: methyl5-(dimethylcarbamoyl)-2-{[({5-[1-(4-ethylphenoxy)ethyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}-4-methylthiophene-3-carboxylate
Smiles: C=CCn1c(SCC(=O)Nc2sc(c(c2C(=O)OC)C)C(=O)N(C)C)nnc1C(Oc1ccc(cc1)CC)C

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Molecular Weight: 571.72
Empirical Formula: C27H33N5O5S2

Physical State: Liquid
Available Amount: 215 mg

Lipinsky:
logP: 5.981
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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