COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL403293
Chemical Name: 3-(3-methyl-4-nitro-1H-pyrazol-1-yl)-N-(2-methyl-4-oxo-5,6,7,8,9,10-hexahydrocycloocta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
Smiles: O=C(Nn1c(C)nc2c(c1=O)c1CCCCCCc1s2)CCn1cc(c(n1)C)[N+](=O)[O-]

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Molecular Weight: 444.51
Empirical Formula: C20H24N6O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.396
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 153
Number of rings: 4

     

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