COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL397905
Chemical Name: N-[4-imino-7-(methylsulfanyl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Smiles: CSc1ncc2c(n1)ncn(c2=N)NC(=O)c1ccc(o1)Cn1ncc(c1)[N+](=O)[O-]

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Molecular Weight: 427.4
Empirical Formula: C16H13N9O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -1.042
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 196
Number of rings: 4

     

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