COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565138
Chemical Name: 4-({[(13E,15S)-15-hydroxy-1,9-dioxoprost-13-en-1-yl]amino}methyl)cyclohexanecarboxylicacid
Smiles: CCCCC[C@@H](/C=C/[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)NCC1CC[C@H](CC1)C(=O)O)O

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Saltdata: Dicyclohexylamine
Molecular Weight: 477.68
Empirical Formula: C28H47NO5

Physical State: Liquid
Available Amount: 65 mg

Lipinsky:
logP: 4.004
Rotatable bonds: 14
H-donors: 3
H-acceptors: 5
PSA: 103
Number of rings: 2

     

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