COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK655791
Chemical Name: (2E)-4-({3-[carboxy(4-ethylpiperazin-1-yl)methyl]-1H-indol-6-yl}amino)-4-oxobut-2-enoicacid
Smiles: CCN1CCN(CC1)C(c1c[nH]c2c1ccc(c2)NC(=O)/C=C/C(=O)O)C(=O)O

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Molecular Weight: 400.43
Empirical Formula: C20H24N4O5

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 0.663
Rotatable bonds: 6
H-donors: 4
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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