Responsive image

Common name

(2S)-pyrrolidine-2-carboxylic acid

IUPAC name

(2S)-pyrrolidine-2-carboxylic acid

SMILES

N1C(CCC1)C(=O)O

Common name

(2S)-pyrrolidine-2-carboxylic acid

IUPAC name

(2S)-pyrrolidine-2-carboxylic acid

SMILES

N1C(CCC1)C(=O)O

INCHI

InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1

FORMULA

C5H9NO2

Responsive image

Common name

(2S)-pyrrolidine-2-carboxylic acid

IUPAC name

(2S)-pyrrolidine-2-carboxylic acid





Molecular weight

115.130

clogP

0.217

clogS

-0.128

Frequency

0.0003





HBond Acceptor

2

HBond Donor

2

Total Polar
Surface Area

49.33

Number of Rings

1

Rotatable Bond

1

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD00061 L-Proline Responsive image Dietary Supplements; Micronutrients; Supplements; Non-Essential Amino Acids; L-Proline is extremely important for the proper functioning of joints and tendons and also helps maintain and strengthen heart muscles.
1 , 1
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
3ip6_ligand_frag_0.mol2 3ip6 1 -7.02 [NH2+]1[C@@H](CCC1)C(=O)O 8
3ip6_ligand.mol2 3ip6 1 -7.02 [NH2+]1[C@H](C(=O)O)CCC1 9
1xhy_ligand_frag_0.mol2 1xhy 1 -6.86 [NH2+]1CCC[C@H]1C(=O)O 8
4f39_ligand_frag_0.mol2 4f39 1 -6.78 [NH2+]1CCC[C@H]1C(=O)O 8
4e0x_ligand_frag_0.mol2 4e0x 1 -6.73 [NH2+]1CCC[C@H]1C(=O)O 8
1tt1_ligand_frag_0.mol2 1tt1 1 -6.69 [NH2+]1CCC[C@H]1C(=O)O 8
1ftk_ligand_frag_0.mol2 1ftk 1 -6.66 [NH2+]1CCC[C@H]1C(=O)O 8
4e0w_ligand_frag_0.mol2 4e0w 1 -6.66 [NH2+]1CCC[C@H]1C(=O)O 8
2xxt_ligand_frag_0.mol2 2xxt 1 -6.65 [NH2+]1CCC[C@H]1C(=O)O 8
106 , 11