COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683368
Chemical Name: 3-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-3-(2-chloro-5-nitrophenyl)propanoicacid
Smiles: OC(=O)CC(c1cc(ccc1Cl)[N+](=O)[O-])NC(=O)c1sc2c(c1Cl)cccc2

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Molecular Weight: 439.28
Empirical Formula: C18H12Cl2N2O5S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.411
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 140
Number of rings: 3

     

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