COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL016005
Chemical Name: 3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoicacid
Smiles: OC(=O)CCn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 213.19
Empirical Formula: C8H11N3O4

Physical State: Dry powder
Available Amount: 727 mg

Lipinsky:
logP: 1.166
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 1

     

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