COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL152379
Chemical Name: 2-{[4-(3-chlorobenzyl)piperazin-1-yl]methyl}-4-[(3-hydroxyphenyl)amino]-4-oxobutanoicacid
Smiles: Oc1cccc(c1)NC(=O)CC(C(=O)O)CN1CCN(CC1)Cc1cccc(c1)Cl

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Molecular Weight: 431.92
Empirical Formula: C22H26ClN3O4

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.493
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 93
Number of rings: 3

     

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