COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK311634
Chemical Name: 1-[(4-tert-butylphenoxy)methyl]-N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1H-pyrazole-3-carboxamide
Smiles: O=C(c1ccn(n1)COc1ccc(cc1)C(C)(C)C)NCCn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 440.5
Empirical Formula: C22H28N6O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.366
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 119
Number of rings: 3

     

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