COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK574730
Chemical Name: (4E)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)-2-(2-nitrophenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C/NCCCN2CCOCC2)/c2ccccc2C(=O)N1c1ccccc1[N+](=O)[O-]

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Molecular Weight: 436.47
Empirical Formula: C23H24N4O5

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 2.195
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 4

     

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