COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK447054
Chemical Name: 6-{[4-(4-bromophenyl)-3-(methoxycarbonyl)thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylicacid
Smiles: COC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)C1CC=CCC1C(=O)O

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Molecular Weight: 464.34
Empirical Formula: C20H18BrNO5S

Physical State: Dry powder
Available Amount: 1222 mg

Lipinsky:
logP: 4.777
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 3

     

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