COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054043
Chemical Name: N-[2-({2-[(2,6-diethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-(pyrrolidin-1-ylcarbonyl)benzamide
Smiles: CCc1cccc(c1NC(=O)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccccc1C(=O)N1CCCC1)CC

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Molecular Weight: 572.75
Empirical Formula: C31H32N4O3S2

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 4.596
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 144
Number of rings: 5

     

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