COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444505
Chemical Name: propan-2-yl5-(diethylcarbamoyl)-4-methyl-2-{[(4-methyl-3,5-dinitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C)CC

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Molecular Weight: 506.54
Empirical Formula: C22H26N4O8S

Physical State: Dry powder
Available Amount: 700 mg

Lipinsky:
logP: 6.134
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 195
Number of rings: 2

     

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