COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK313835
Chemical Name: N-(2-{[(E)-(3-bromophenyl)methylidene]amino}ethyl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)[N+](=O)[O-])C)NCC/N=C/c1cccc(c1)Br

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Molecular Weight: 408.25
Empirical Formula: C16H18BrN5O3

Physical State: Dry powder
Available Amount: 16 mg

Lipinsky:
logP: 2.937
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 105
Number of rings: 2

     

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