COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456382
Chemical Name: N-(1,3-benzodioxol-5-yl)-2-({5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}carbonyl)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc2c(c1)OCO2)NNC(=O)c1ccc(o1)Cn1cc(c(n1)[N+](=O)[O-])Br

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Molecular Weight: 509.3
Empirical Formula: C17H13BrN6O6S

Physical State: Dry powder
Available Amount: 238 mg

Lipinsky:
logP: 2.018
Rotatable bonds: 4
H-donors: 3
H-acceptors: 6
PSA: 180
Number of rings: 4

     

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