COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046908
Chemical Name: N-[(2E)-5-[(E)-1-cyano-2-{1-[2-(2-methoxyphenoxy)ethyl]-1H-indol-3-yl}ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)CCOc1ccccc1OC)/c1n[nH]/c(=N\C(=O)c2ccccc2)/s1

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Molecular Weight: 521.6
Empirical Formula: C29H23N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.442
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 5

     

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