COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305181
Chemical Name: 3-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole
Smiles: CCn1cc(c(n1)c1nnc(n1CC1CCCO1)SCn1ncc(c1)[N+](=O)[O-])Cl

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Molecular Weight: 438.9
Empirical Formula: C16H19ClN8O3S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 2.039
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 146
Number of rings: 4

     

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