COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151966
Chemical Name: 2-[(4-acetylpiperazin-1-yl)methyl]-4-{[2-(methoxycarbonyl)thiophen-3-yl]amino}-4-oxobutanoicacid
Smiles: COC(=O)c1sccc1NC(=O)CC(C(=O)O)CN1CCN(CC1)C(=O)C

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Molecular Weight: 397.45
Empirical Formula: C17H23N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.117
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 144
Number of rings: 2

     

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