General Information of DIG (ID: E02AQT)
DIG Name
Proline
Synonyms    Click to Show/Hide the Synonyms of This DIG
L-proline; 147-85-3; proline; L-(-)-Proline; (S)-Pyrrolidine-2-carboxylic acid; H-Pro-OH; 2-pyrrolidinecarboxylic acid; (2S)-pyrrolidine-2-carboxylic acid; (-)-Proline; (-)-(S)-Proline; (S)-2-Pyrrolidinecarboxylic acid; Prolinum; (-)-2-Pyrrolidinecarboxylic acid; L-Pyrrolidine-2-carboxylic acid; prolina; (S)-Proline; L-alpha-Pyrrolidinecarboxylic acid; L-Prolin; Prolinum [Latin]; Prolina [Spanish]; Proline, L-; Proline (VAN); (S)-2-Carboxypyrrolidine; Proline [USAN:INN]; (L)-PROLINE; (S)-(-)-Proline; 2-Pyrrolidinecarboxylic acid, (S)-; FEMA Number 3319; CB 1707; PRO (IUPAC abbreviation); FEMA No. 3319; HSDB 1210; UNII-9DLQ4CIU6V; AI3-26710; MFCD00064318; 9DLQ4CIU6V; CHEMBL54922; CHEBI:17203; Proline (L-Proline); Prolin; Carboxypyrrolidine; L-(2,3-3H)Proline; Proline (USP); L-Proline, labeled with carbon-14; EINECS 205-702-2; NSC 46703; 2-Pyrrolidinecarboxylate; racemic proline; rac-proline; s-proline; NSC-97923; 3h-l-proline; L-Proline;; (s)-prolin; femanumber3319; H-Pro; (2S)-proline; Pro-OH; L-Proline,(S); L-Pro-OH; (-)-Proline (S)-2-Carboxypyrrolidine; L-Proline (JP17); 2-Pyrrolidinecarboxylicacid; bmse000047; bmse000947; EC 205-702-2; (2S)-2-carboxypyrrolidine; SCHEMBL7792; H-Pro-2-Chlorotrityl Resin; (S)-2-Pyrralidinecarboxylate; (S)-2-Pyrrolidinecarboxylate; (-)-2-Pyrrolidinecarboxylate; L(-)-Proline, 99+%; (s)-2-pyrrolidinecarboxylicaci; (S)-(-)-PROLIN; GTPL3314; (s)-2-pyrrolidinecarboxylicacid; DTXSID5044021; L-Proline, 99%, FCC, FG; (S)-2-Pyrralidinecarboxylic acid; pyrrolidin-2-(S)-carboxylic acid; Pharmakon1600-01301007; ZINC895360; (2S)-Pyrrolidin-2-carbonsalphaure; pyrrolidine-2-(S)-carboxylic acid; BCP25292; HY-Y0252; (S) -pyrrolidine-2-carboxylic acid; L-Proline, >=99.0% (NT); (S)-(-)-Pyrrolidine-2-carboxylate; ANW-49297; BDBM50000100; L-Proline - CAS 147-85-3; NCGC00014017; NSC760114; s5629; AKOS010372120; AKOS015856025; CCG-214709; CS-W019861; DB00172; MCULE-8415049837; NSC-760114; (S)-(-)-Pyrrolidine-2-carboxylic acid; NCGC00014017-02; NCGC00014017-03; NCGC00097126-01; 37159-97-0; 4305-67-3; AC-11190; AS-10803; L-Proline, BioUltra, >=99.5% (NT); AB0064943; DB-029981; L-Proline, SAJ special grade, >=99.0%; AM20080359; BB 0242381; L-Proline, Vetec(TM), 98.5-101.5%; P0481; L-Proline, Vetec(TM) reagent grade, >=99%; C00148; D00035; L-Proline, ReagentPlus(R), >=99% (HPLC); M-5893; M02947; 27675-EP2298767A1; 27675-EP2314587A1; 65150-EP2272510A1; 65150-EP2277898A2; 65150-EP2284159A1; 65150-EP2287165A2; 65150-EP2287166A2; 65150-EP2289892A1; 65150-EP2292620A2; 65150-EP2292630A1; 65150-EP2295439A1; 65150-EP2305687A1; 65150-EP2308812A2; 125850-EP2272510A1; 125850-EP2295422A2; 147P853; Q-201327; L-Proline, certified reference material, TraceCERT(R); Q20035886; A01B5B63-CC3D-4796-A7B4-C2DE26A6FA93; F0001-2348; Proline, European Pharmacopoeia (EP) Reference Standard; Z1245635771; UNII-0O72R8RF8A component ONIBWKKTOPOVIA-BYPYZUCNSA-N; UNII-DCS9E77JPQ component ONIBWKKTOPOVIA-BYPYZUCNSA-N; L-Proline, United States Pharmacopeia (USP) Reference Standard; L-Proline, Pharmaceutical Secondary Standard; Certified Reference Material; L-Proline, from non-animal source, meets EP, USP testing specifications, suitable for cell culture; L-Proline, PharmaGrade, Ajinomoto, EP, JP, USP, Manufactured under appropriate GMP controls for pharma or biopharmaceutical production, suitable for cell culture
DIG Function
Dispersing agent
PubChem CID
145742
Formula
C5H9NO2
Canonical SMILES
C1C[C@H](NC1)C(=O)O
InChI
1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1
InChIKey
ONIBWKKTOPOVIA-BYPYZUCNSA-N
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
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3D MOL 2D MOL
Physicochemical Properties Molecular Weight 115.13 Topological Polar Surface Area 49.3
XlogP -2.5 Complexity 103
Heavy Atom Count 8 Rotatable Bond Count 1
Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 3
Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
      Hydrolase (HDase)
            DBT Name: Angiotensin-converting enzyme (ACE) Click to Show/Hide
               Detailed Information DBT Info click to show the detail info of this DBT
               Experiment for Assessing the Biological Activity of the Studied DIG on This DBT
                    Biological Activity Ki = 86000 nM (tested by experiment) [1]
                    Tested Species Homo sapiens (Human)
                    UniProt ID ACE_HUMAN
References
1 Experimental confirmation of new drug-target interactions predicted by Drug Profile Matching. J Med Chem. 2013 Nov 14; 56(21):8377-88.

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