COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK684550
Chemical Name: methyl4-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-4-(2,6-dioxo-4-phenylcyclohexylidene)butanoate
Smiles: COC(=O)CC/C(=C\1/C(=O)CC(CC1=O)c1ccccc1)/NCCc1nc2c([nH]1)cccc2

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Molecular Weight: 445.52
Empirical Formula: C26H27N3O4

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 3.621
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 101
Number of rings: 4

     

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