COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK537364
Chemical Name: N-[1-(4-hydroxyphthalazin-1-yl)-2-{(2E)-2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-2-oxoethyl]benzamide
Smiles: O=C(C(c1nnc(c2c1cccc2)O)NC(=O)c1ccccc1)N/N=C/c1ccc(s1)[N+](=O)[O-]

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Molecular Weight: 476.47
Empirical Formula: C22H16N6O5S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 3.183
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 190
Number of rings: 4

     

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