COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL305620
Chemical Name: 1-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone
Smiles: COc1cc(ccc1OC)CCn1c(C)cc(c1C)C(=O)CSc1nnc2n1c1ccccc1c(c2)C

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Molecular Weight: 514.65
Empirical Formula: C29H30N4O3S

Available Amount: 0 mg

Lipinsky:
logP: 6.619
Rotatable bonds: 9
H-donors: 0
H-acceptors: 3
PSA: 95
Number of rings: 5

     

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