COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK364749
Chemical Name: 4-({4-[(1E)-2-cyano-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-1-yl]phenoxy}methyl)benzoicacid
Smiles: N#C/C(=C\c1ccc(cc1)OCc1ccc(cc1)C(=O)O)/C(=O)NCCc1c[nH]c2c1cccc2

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Molecular Weight: 465.51
Empirical Formula: C28H23N3O4

Physical State: Dry powder
Available Amount: 232 mg

Lipinsky:
logP: 4.368
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 115
Number of rings: 4

     

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