COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK661572
Chemical Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-beta-alanine
Smiles: OC(=O)CCNc1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 278.19
Empirical Formula: C10H9F3N2O4

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 2.79
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 95
Number of rings: 1

     

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