Bioactive Compound Details

BioIDbio126555
NameAR-12
ChEMBL IDCHEMBL1650595
Molecular FormulaC26H19F3N4O
Molecular Weight460.46
Molecular Weight (Monoisotopic)460.1511
TypeSmall molecule
Max PhasePhase 1
Target IDTar94
Target NameNone
SynonymsAR-12|OSU-03012|PDK1 INHIBITOR AR-12
SmilesNCC(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2-c2ccc3c(ccc4ccccc43)c2)cc1
InchiInChI=1S/C26H19F3N4O/c27-26(28,29)24-14-23(33(32-24)20-10-8-19(9-11-20)31-25(34)15-30)18-7-12-22-17(13-18)6-5-16-3-1-2-4-21(16)22/h1-14H,15,30H2,(H,31,34)
Inchi KeyYULUCECVQOCQFQ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets43.0
Bioactivities109.0
Np Likeness Score-1.14
Records Key['23', 'AR-12, OSU-03012', 'OSU-03012', 'AR-12', 'AR-12', '1, QSU-03012', 'AR-12', 'BDBM50430630', 'SID172131582', '69', 'AR-12', 'OSU-03012', 'AR-12', 'AR-12', 'MMV1578560', 'AR-12', '63; OSU-03012, AR-12', 'OSU-0312', 'AR12', 'EOS100059']
Records Name['2-amino-N-(4-(5-(phenanthren-2-yl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)acetamide', '2-amino-N-(4-(5-(phenanthren-2-yl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)acetamide', 'OSU-03012', 'AR-12', 'AR-12', '2-amino-N-(4-(5-(phenanthren-2-yl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)acetamide', 'AR-12', 'CHEMBL1650595::US8741944, 70', 'SID172131582', '2-amino-N-(4-(5-(phenanthren-2-yl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)acetamide', 'AR-12', 'OSU-03012', 'AR-12', 'AR-12', 'C0088449', 'AR-12', '2-amino-N-(4-(5-(phenanthren-2-yl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)acetamide', '2-amino-N-(4-(5-(phenanthren-2-yl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)acetamide', '2-amino-N-(4-(5-(phenanthren-2-yl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)phenyl)acetamide', 'OSU03012']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure