COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182572
Chemical Name: (2E)-2-cyano-3-{4-[(4-nitrobenzyl)oxy]phenyl}-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])/C(=O)NCC1CCCO1

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Molecular Weight: 407.43
Empirical Formula: C22H21N3O5

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 2.439
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 3

     

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