COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK651638
Chemical Name: (2E)-4-[(3-{carboxy[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl}-1H-indol-6-yl)amino]-4-oxobut-2-enoicacid
Smiles: C[C@@H]1C[C@H](C)CN(C1)C(c1c[nH]c2c1ccc(c2)NC(=O)/C=C/C(=O)O)C(=O)O

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Molecular Weight: 399.45
Empirical Formula: C21H25N3O5

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 2.61
Rotatable bonds: 6
H-donors: 4
H-acceptors: 5
PSA: 122
Number of rings: 3

     

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