COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553613
Chemical Name: N'-[(E)-(3-nitrophenyl)methylidene]tetrahydro-3a'H-dispiro[cyclohexane-1,2'-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-7',1''-cyclohexane]-5'-carbohydrazide(non-preferredname)
Smiles: O=C(C1OC2OC3(OC2C2C1OC1(O2)CCCCC1)CCCCC3)N/N=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 501.54
Empirical Formula: C25H31N3O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.106
Rotatable bonds: 3
H-donors: 1
H-acceptors: 8
PSA: 133
Number of rings: 6

     

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