COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054117
Chemical Name: 4-chloro-2-[1-(4H-1,2,4-triazol-1-ium-4-ylamino)ethyl]phenolate
Smiles: Clc1ccc(c(c1)C(Nn1c[nH+]nc1)C)[O-]

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Molecular Weight: 238.68
Empirical Formula: C10H11ClN4O

Physical State: Dry powder
Available Amount: 239 mg

Lipinsky:
logP: 1.289
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 67
Number of rings: 2

     

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