COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK424319
Chemical Name: 1,4,5,6,7,7-hexachloro-3-{[3-(methoxycarbonyl)-5-methyl-4-phenylthiophen-2-yl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylicacid
Smiles: COC(=O)c1c(NC(=O)C2C(C(=O)O)C3(C(C2(Cl)C(=C3Cl)Cl)(Cl)Cl)Cl)sc(c1c1ccccc1)C

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Molecular Weight: 618.15
Empirical Formula: C22H15Cl6NO5S

Physical State: Dry powder
Available Amount: 1301 mg

Lipinsky:
logP: 8.293
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 4

     

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