COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL033109
Chemical Name: methyl(2E)-3-(3-chloro-1H-1,2,4-triazol-5-yl)prop-2-enoate
Smiles: COC(=O)/C=C/c1nc(n[nH]1)Cl

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Molecular Weight: 187.59
Empirical Formula: C6H6ClN3O2

Physical State: Dry powder
Available Amount: 1005 mg

Lipinsky:
logP: 0.606
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 67
Number of rings: 1

     

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