Details of the Drug

General Information of Drug (ID: DMTUHFX)

Drug Name
D-Phenylalanine
Synonyms
D-phenylalanine; 673-06-3; H-D-Phe-OH; (2R)-2-amino-3-phenylpropanoic acid; Sabiden; Phenylalanine D-form; D-Phe; (R)-2-AMINO-3-PHENYLPROPANOIC ACID; Alanine, phenyl-, D-; NCI-C60195; UNII-032K16VRCU; (R)-2-Amino-3-phenylpropionic acid; D-alpha-Amino-beta-phenylpropionic acid; CCRIS 6267; EINECS 211-603-5; NSC 25005; 032K16VRCU; CHEBI:16998; COLNVLDHVKWLRT-MRVPVSSYSA-N; MFCD00004270; D-Phenylalanine, 99+%; d-phenylalanin; D-.beta.-Phenylalanine; Phenylalanine,d-; DPhe; l-3-phenylalanine; HDPheOH; (D)-Phenylalanine; Phenylalanine,(S)
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 165.19
Topological Polar Surface Area (xlogp) -1.5
Rotatable Bond Count (rotbonds) 3
Hydrogen Bond Donor Count (hbonddonor) 2
Hydrogen Bond Acceptor Count (hbondacc) 3
Chemical Identifiers
Formula
C9H11NO2
IUPAC Name
(2R)-2-amino-3-phenylpropanoic acid
Canonical SMILES
C1=CC=C(C=C1)C[C@H](C(=O)O)N
InChI
InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m1/s1
InChIKey
COLNVLDHVKWLRT-MRVPVSSYSA-N
Cross-matching ID
PubChem CID
71567
ChEBI ID
CHEBI:16998
CAS Number
673-06-3
DrugBank ID
DB02556
TTD ID
D0B3LN

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Corticoliberin (CRH) TTA7YIZ CRF_HUMAN Inhibitor [2]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5797).
2 How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6.
3 The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42.