COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL158181
Chemical Name: 3-[(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)amino]-4-[(pyridin-2-ylmethyl)amino]cyclobut-3-ene-1,2-dione
Smiles: O=C1C(=O)C(=C1NCc1ccccn1)NCC1COc2c(O1)cccc2

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Molecular Weight: 351.36
Empirical Formula: C19H17N3O4

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 0.452
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 89
Number of rings: 4

     

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