MetaADEDB 2.0 @ LMMD
Acrolein
(HGINCPLSRVDWNT-UHFFFAOYSA-N)
Structure
SMILES
C=CC=O
Molecular Formula:
C3H4O
Molecular Weight:
56.063
Log P:
0.3713
Hydrogen Bond Acceptor:
1
Hydrogen Bond Donor:
0
TPSA:
17.07
CAS Number(s):
107-02-8; 25068-14-8; 81788-96-7
Synonym(s)
1.
Acrolein
2.
2-Propenal
3.
Acraldehyde
4.
Acrylaldehyde
5.
Acrylic Aldehyde
6.
Allyl Aldehyde
7.
Aqualin
8.
Ethylene Aldehyde
9.
2 Propenal
10.
Aldehyde, Acrylic
11.
Aldehyde, Allyl
12.
Aldehyde, Ethylene
External Link(s)
MeSHD000171
PubChem Compound7847
BindingDB50010912
ChEBI15368
CHEMBLCHEMBL721
IUPHAR/BPS Guide to PHARMACOLOGY2418
KEGGcpd:C01471
Therapeutic Target DatabaseD0I0AA
ZINC897143
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Acute Lung Injury20525806
21297076
27592100		CTD
2Arteriosclerosis15014928CTD
3Atherosclerosis16037261
16126721
17363696		CTD
4Bradycardia27592100CTD
5Cardiovascular Diseases25099132CTD
6Chemical and Drug Induced Liver Injury23220588CTD
7Cognition Disorders23296102
29355571		CTD
8Colorectal Neoplasms17597105CTD
9Cystitis

View details

4032564
6792207
8501819
12161096
16708234
22961095
 		CTD
10Disorders of Environmental Origin17938725CTD
11Dyspnea27592100CTD
12Hemorrhage

View details

6792207
7308258
16708234
22961095
 		CTD
13Hyperglycemia28541489CTD
14Hyperplasia19464576
20359552		CTD
15Inflammation7308258
21265103
28541489		CTD
16Kidney Diseases12488133
17891346		CTD
17Lung Injury24211530CTD
18Lung Neoplasms19146376CTD
19Lung diseases11504702
18515264		CTD
20Melanoma, Experimental10803710CTD
21Metaplasia20359552CTD
22Mouth Breathing27592100CTD
23Necrosis16267686CTD
24Neoplasms17329238CTD
25Nephritis12653641CTD
26Nerve Degeneration23296102CTD
27Nose Diseases27592100CTD
28Pain3108189
10840460		CTD
29Parkinson Disease17690948CTD
30Photosensitivity Disorders11550810CTD
31Pulmonary Edema24594012
27592100		CTD
32Reflex, Abnormal8032584CTD
33Renal Insufficiency12732208CTD
34Respiratory Hypersensitivity30608172CTD
35Respiratory Insufficiency27592100CTD
36Smoke Inhalation Injury20015449CTD
37Sneezing27545873CTD
38Tracheal Diseases27592100CTD
39Urinary Bladder Diseases7548731CTD
40Ventricular Dysfunction, Left27746315CTD
41Ventricular Dysfunction27592100CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120239

Copyright © 2019-2020 Laboratory of Molecular Modeling and Design, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology. All rights reserved.