COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK644584
Chemical Name: (2E)-N-[(2Z)-5-[(2-{[2-(4-chlorophenoxy)ethyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: O=C(CSc1n[nH]/c(=N/C(=O)/C=C/c2ccccc2)/s1)NCCOc1ccc(cc1)Cl

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Molecular Weight: 474.99
Empirical Formula: C21H19ClN4O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.584
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 142
Number of rings: 3

     

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