COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK619092
Chemical Name: (E)-N-{2-[({5-[(dimethylamino)methyl]furan-2-yl}methyl)sulfanyl]ethyl}-N'-methyl-2-nitroethene-1,1-diamine
Smiles: CN/C(=C\[N+](=O)[O-])/NCCSCc1ccc(o1)CN(C)C

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Saltdata: HCl
Molecular Weight: 314.41
Empirical Formula: C13H22N4O3S

Physical State: Dry powder
Available Amount: 330 mg

Lipinsky:
logP: 1.231
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 111
Number of rings: 1

     

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