COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL081451
Chemical Name: N-(3-chloro-4-methoxyphenyl)-2-{4,6-dioxo-5-[4-(propan-2-yl)phenyl]-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl}acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CN1N=NC2C1C(=O)N(C2=O)c1ccc(cc1)C(C)C

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Molecular Weight: 455.9
Empirical Formula: C22H22ClN5O4

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 2.775
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 4

     

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