COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL153643
Chemical Name: methyl3-{(3Z)-3-[(6-chloro-1H-indol-3-yl)methylidene]-2,5-dioxopyrrolidin-1-yl}thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1N1C(=O)C/C(=C/c2c[nH]c3c2ccc(c3)Cl)/C1=O

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Molecular Weight: 400.84
Empirical Formula: C19H13ClN2O4S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.032
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 4

     

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