COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561584
Chemical Name: N-[(2E)-5-[(E)-2-{1-[2-(2-chlorophenoxy)ethyl]-1H-indol-3-yl}-1-cyanoethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)CCOc1ccccc1Cl)/c1n[nH]/c(=N\C(=O)c2ccccc2)/s1

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Molecular Weight: 526.02
Empirical Formula: C28H20ClN5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.166
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 117
Number of rings: 5

     

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