Details of the Drug

General Information of Drug (ID: DM82TMA)

• Drug Name: Proline
• Synonyms: D,L-proline; D-Pyrrolidine-2-carboxylic acid; DL proline; DL-Proline; DL-Proline, 99%; DL-Proline,(S); H-DL-Pro-OH; L-Proline, homopolymer; ONIBWKKTOPOVIA-UHFFFAOYSA-N; Poly(DL-proline); Poly(L-proline); Prolin; Proline #; Proline DL-form; Proline, DL-; PubChem20613; d,1-proline; laevo-proline; proline; proline;; pyrrolidine-2-carboxylic acid; (+/-)-Pyrrolidine-2-carboxylic acid; 2-Pyrrolidine carboxylic acid; 609-36-9; CCCu; CCRIS 8602; CHEBI:26271; CHEMBL72275; EINECS 210-189-3; Hpro; MFCD00005250; NSC 97923; NSC-97923; NSC97923
• #Ro5 Violations (Lipinski): 1:
  Molecular Weight (mw); 115.13
  Logarithm of the Partition Coefficient (xlogp); -2.5
  Rotatable Bond Count (rotbonds); 1
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 3
• Chemical Identifiers:
  Formula: C5H9NO2
  IUPAC Name: pyrrolidine-2-carboxylic acid
  Canonical SMILES: C1CC(NC1)C(=O)O
  InChI: ONIBWKKTOPOVIA-UHFFFAOYSA-N
  InChIKey: 1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)
• Cross-matching ID:
  PubChem CID: 614
  ChEBI ID: CHEBI:26271
  CAS Number: 609-36-9
  DrugBank ID: DB00172
  INTEDE ID: DR1350

Molecular Interaction Atlas of This Drug

Drug-Metabolizing Enzyme (DME)

DME Name	DME ID	UniProt ID	MOA	REF
Proline dehydrogenase 1 (PRODH) Main DME	DEVJIHS	PROD_HUMAN	Substrate	[1]

References

• [1] Proline metabolism and microenvironmental stress. Annu Rev Nutr. 2010 Aug 21;30:441-63.