COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL250029
Chemical Name: 2-({4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}methyl)-4-[(4-hydroxyphenyl)amino]-4-oxobutanoicacid
Smiles: CN(C(=O)CN1CCN(CC1)CC(C(=O)O)CC(=O)Nc1ccc(cc1)O)C

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Saltdata: (CH3)2NCO
Molecular Weight: 392.46
Empirical Formula: C19H28N4O5

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: -0.508
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 113
Number of rings: 2

     

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