COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK619599
Chemical Name: (2Z)-2-(4-tert-butylbenzylidene)-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/c2ccc(cc2)C(C)(C)C)/Oc2c1ccc(c2C[NH+]1CCCC1)[O-]

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Molecular Weight: 377.48
Empirical Formula: C24H27NO3

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 4.63
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 53
Number of rings: 4

     

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