COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305785
Chemical Name: 2-[3-(4-bromo-3-nitro-1H-pyrazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]-1-[5-(2-hydroxyphenyl)-3-(3-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: COc1cccc(c1)C1=NN(C(C1)c1ccccc1O)C(=O)C[C@]12CC3CC(C1)CC(C2)(C3)n1nc(c(c1)Br)[N+](=O)[O-]

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Molecular Weight: 634.53
Empirical Formula: C31H32BrN5O5

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 4.073
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 8

     

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