COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK657688
Chemical Name: (2E)-4-[(3-{carboxy[4-(pyridin-2-yl)piperazin-1-yl]methyl}-1H-indol-5-yl)amino]-4-oxobut-2-enoicacid
Smiles: O=C(Nc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)c1ccccn1)C(=O)O)/C=C/C(=O)O

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Molecular Weight: 449.47
Empirical Formula: C23H23N5O5

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 1.47
Rotatable bonds: 6
H-donors: 4
H-acceptors: 5
PSA: 138
Number of rings: 4

     

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