COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK814977
Chemical Name: 6-[(5Z)-4-oxo-5-(2-oxo-1-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-1,2-dihydro-3H-indol-3-ylidene)-2-thioxo-1,3-thiazolidin-3-yl]hexanoicacid
Smiles: O=C(CN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCCCCC(=O)O)/c2c1cccc2)NCCc1ccccc1

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Saltdata: 1/5CH3COOH
Molecular Weight: 537.66
Empirical Formula: C27H27N3O5S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 1.586
Rotatable bonds: 11
H-donors: 2
H-acceptors: 5
PSA: 164
Number of rings: 4

     

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