COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381552
Chemical Name: (2Z,5Z)-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-{[4-(morpholin-4-yl)phenyl]imino}-3-(2-phenylethyl)-1,3-thiazolidin-4-one
Smiles: CCn1/c(=C\2/S/C(=N\c3ccc(cc3)N3CCOCC3)/N(C2=O)CCc2ccccc2)/sc2c1cccc2

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Molecular Weight: 542.73
Empirical Formula: C30H30N4O2S2

Physical State: Dry powder
Available Amount: 614 mg

Lipinsky:
logP: 4.29
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 98
Number of rings: 6

     

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