COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK716988
Chemical Name: trans-4-({[(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}methyl)cyclohexanecarboxylicacid
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)NC[C@@H]1CC[C@H](CC1)C(=O)O

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Molecular Weight: 358.4
Empirical Formula: C18H22N4O4

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 1.04
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 111
Number of rings: 3

     

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