 |
| Ligand Name: vildagliptin |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB1061 |
PubChem:
6918537
|
Synonym(s):
- galvus
- xiliarx
- 274901-16-5
- jalra
- nvp-laf237
- equa
- laf 237
- laf-237
- nvp-laf-237
- laf237
- vildagliptin (laf-237)
- unii-i6b4b2u96p
- nvp-laf 237
- (2s)-1-[2-[(3-hydroxy-1-adamantyl)amino]acetyl]pyrrolidine-2-carbonitrile
- chembl142703
- i6b4b2u96p
- 2-pyrrolidinecarbonitrile, 1-[2-[(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)amino]acetyl]-, (2s)-
- (2s)-1-{2-[(3-hydroxyadamantan-1-yl)amino]acetyl}pyrrolidine-2-carbonitrile
- 2-pyrrolidinecarbonitrile, 1-(((3-hydroxytricyclo(3.3.1.13,7)dec-1-yl)amino)acetyl)-, (2s)-
- galvus (tn)
- vidagliptin (see vildagliptin)
- zomelis
- vildagliptin (jan/usan/inn)
- (2s)-1-(2-((3-hydroxyadamantan-1-yl)amino)acetyl)pyrrolidine-2-carbonitrile
- a10bh02
- vildagliptin [usan:inn:ban:jan]
- equa (tn)
- schembl16579
- gtpl6310
- pyr288
- vildagliptin (nvp-laf 237)
- bdbm11695
- a10bd08
- dtxsid80881091
- (s)-1-(2-(((1r,3r,5r,7s)-3-hydroxyadamantan-1-yl)amino)acetyl)pyrrolidine-2-carbonitrile
- chebi:135285
- (2s)-1-[n-(3-hydroxyadamantan-1-yl)glycyl]pyrrolidine-2-carbonitrile
- fd6071
- s3033
- (s)-1-[2-[(3-hydroxyadamant-1-yl)amino]acetyl]pyrrolidine-2-carbonitrile
- akos015898120
- ac-1273
- ccg-267505
- cs-1465
- db04876
- ncgc00386200-01
- ncgc00386200-02
- hy-14291
- am20090695
- sw220049-1
- d07080
- s-4169
- ab01566863_01
- q421042
- (2s)-{((3-hydroxyadamantan-1-yl)amino)acetyl}pyrrolidine-2-carbonitrile
- (2s)-1-{[(3-hydroxyadamant-1-yl)amino]acetyl}pyrrolidine-2-carbonitrile
- (2s)-1-{2-[(3-hydroxyadamant-1-yl)amino]acetyl}pyrrolidine-2-carbonitrile
- (2s)-1-{[(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)amino]acetyl}pyrrolidine-2-carbonitrile
- 1-[2-[(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)amino]acetyl]-2s-pyrrolidinecarbonitrile
- 2s)-1-[[(3-hydroxytricyclo[3.3.1.13,7]decane-1-yl)amino]acetyl]-2-pyrrolidinecarbonitrile
show 59 synonym(s)
|
| DrugBank: DB04876 |
ChEMBL: CHEMBL142703 |
| Canonical SMILES: OC12CC3CC(C1)CC(C3)(C2)NCC(=O)N1CCC[C@H]1C#N |
| Standard InChI: InChI=1S/C17H25N3O2/c18-9-14-2-1-3-20(14)15(21)10-19-16-5-12-4-13(6-16)8-17(22,7-12)11-16/h12-14,19,22H,1-8,10-11H2/t12?,13?,14-,16?,17?/m0/s1 |
| Molecular Formula: C17H25N3O2 |
Mol. Weight: 303.19467 |
logP: 1.17428 |
| HBD: 2 | HBA: 4 |
| #Rotatable Bonds: 3 | TPSA: 76.36 |