Compound - Results

Ethyl Chloride

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Information Structure
Name Ethyl chloride
Synonyms
Aethylchlorid
Aethylchloride
Aethylis Chloridum
AI3-24474
Anodynon
CCRIS 3349
Chelen
Chloorethaan
Chlorene
Chlorethyl
Chloroaethan
Chloroethane
Chlorure Dethyle
Chloryl
Chloryl Anesthetic
Cloretilo
Cloroetano
Cloruro Di Etile
Dublofix
EINECS 200-830-5
Ethane, Chloro-
Ether Chloratus
Ether Chloridum
Ether Hydrochloric
Ether Muriatic
Ethyl Chloride
Etylu Chlorek
HSDB 533
Hydrochloric Ether
Kelene
Monochlorethane
Monochloroethane
Muriatic Ether
Narcotile
NCI-C06224
ATC N01BX01
CID 6337
CAS 000075003
SMILES CCCl
Formula C2H5Cl
Molweight 64.5141
Atoms 3
LogP 1.2451
Rotatable Bonds 0
H-Bond Donors 0
H-Bond Acceptors 0
Dyclonine

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Information Structure
Name Dyclonine
Synonyms
5-20-02-00393 (Beilstein Handbook Reference)
BRN 0224037
Diclonina
Dyclocaine
Dyclocainum
Dyclonin
Dyclonine
Dycloninum
ATC N01BX02
R02AD04
CID 3180
CAS 000586607
Drugbank ID DB00645
TTD Drug ID DAP000509
SMILES CCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2
Formula C18H27NO2
Molweight 289.412
Atoms 21
LogP 3.8621
Rotatable Bonds 8
H-Bond Donors 0
H-Bond Acceptors 3
Phenol

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Information Structure
Name Phenol
Synonyms
Acide Carbolique
AI3-01814
Bakers P & S Liquid & Ointment
Bakers P And S Liquid And Ointment
Benzenol
Carbolic Acid
Carbolsaure
Caswell No. 649
CCRIS 504
EINECS 203-632-7
EPA Pesticide Chemical Code 064001
FEMA No. 3223
Fenol
Fenolo
HSDB 113
Hydroxybenzene
Izal
Liquid Phenol
Monohydroxybenzene
Monophenol
NCI-C50124
NSC 36808
Oxybenzene
Paoscle
Phenic Acid
Phenol
Phenol Alcohol
Phenol, Liquefied
Phenole
Phenyl Alcohol
Phenyl Hydrate
Phenyl Hydroxide
Phenylic Acid
Phenylic Alcohol
PhOH
RCRA Waste Number U188
UN 1671 (solid)
UN 2312 (molten)
Un 2812 (solution)
ATC C05BB05
D08AE03
N01BX03
R02AA19
CID 996
CAS 000108952
Drugbank ID DB03255
Herbal origin Illicium Bark
Snowbellleaf tickclover herb
twig of Winged Euonymus
SMILES OC1=CC=CC=C1
Formula C6H6O
Molweight 94.1112
Atoms 7
LogP 1.3922
Rotatable Bonds 0
H-Bond Donors 0
H-Bond Acceptors 1
CYP interactions
NameRelationsReferences
2E1Substrate 8917693
8571359
7923572
7802633
8692217
10976571
11996015
2F1Substrate 11701230
Phase2 interactions
NameReferences
UGT 109087,
1685137,
8236256,
9358559,
10670822,
7872955,
18089525,
17956868,
11940451,
9429234,
7138576
Transporter
AC-No.NameReferences
P78381SLC35A2 17686537
Capsaicin

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Information Structure
Name Capsaicin
Synonyms
(E)-8-Methyl-N-vanillyl-6-nonenamide
(E)-N-((4-Hydroxy-3-methoxyphenyl)-methyl)-8-methyl-6-nonenamide
4-13-00-02588 (Beilstein Handbook Reference)
6-Nonenamide, 8-methyl-N-vanillyl-, (E)-
6-Nonenamide, N-((4-hydroxy-3-methoxyphenyl)methyl)-8-methyl-, (E)-
8-Methyl-N-vanillyl-6-nonenamide, (E)-
BRN 2816484
Capsaicin
Capsaicine
Caswell No. 158
CCRIS 1588
EINECS 206-969-8
EPA Pesticide Chemical Code 070701
FEMA No. 3404
HSDB 954
Isodecenoic Acid Vanillylamide
N-((4-Hydroxy-3-methoxyphenyl)methyl)-8-methyl-6-nonenamide, (E)-
N-(4-Hydroxy-3-methoxybenzyl)-8-methylnon-trans-6-enamide
NCI-C56564
NSC 56353
Styptysat
trans-8-Methyl-N-vanillyl-6-nonenamide
ATC N01BX04
M02AB01
CID 1548943
CAS 000404864
TTD Drug ID DNC001149
Herbal origin pericarp of bretschneider Pear
SMILES COC1=C(O)C=CC(CNC(=O)CCCCC=CC(C)C)=C1
Formula C18H27NO3
Molweight 305.412
Atoms 22
LogP 4.1805
Rotatable Bonds 10
H-Bond Donors 2
H-Bond Acceptors 4
CYP interactions
NameRelationsReferences
1A1Substrate 12641434
12641434
1A2Substrate 12641434
12641434
2B6Substrate 12641434
12641434
2C8Substrate 12641434
12641434
2C9Substrate 12641434
12641434
2C19Substrate 12641434
2D6Substrate 12641434
12641434
2E1Substrate umm
12641434
3A4Substrate 12641434
12641434
Transporter
AC-No.NameReferences
P78381SLC35A2 17686537
Diphenhydramin

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Information Structure
Name Diphenhydramin
Synonyms
2-(Benzhydryloxy)-N,N-dimethylethylamine
2-(Diphenylmethoxy)-N,N-dimethylethylamine
4-10-00-00125 (Beilstein Handbook Reference)
Alledryl
Allergical
alpha-(2-Dimethylaminoethoxy)diphenylmethane
Amidryl
Antistominum
Antomin
Automin
Bagodryl
Baramine
Benachlor
Benadrin
Benapon
Benodin
Benodine
Benylan
Benzantine
Benzhydramine
Benzhydraminum
Benzhydril
Benzhydroamina
beta-Dimethylamino-aethyl-benzhydryl-aether
beta-Dimethylaminoethanol Diphenylmethyl Ether
beta-Dimethylaminoethylbenzhydrylether
Betramin
BRN 1914136
CCRIS 1959
Dabylen
Debendrin
Dermistina
Dermodrin
Desentol
Diabenyl
Diabylen
Dibondrin
Difedryl
Difenhidramina
Difenhydramin
Difenidramina
Dihidral
Dimedrol Base
Diphantine
Diphenhydramin
Diphenhydramine
Diphenhydraminum
Drylistan
Dylamon
EINECS 200-396-7
Etanautine
Ethanamine, 2-(diphenylmethoxy)-N,N-dimethyl-
Ethylamine, N,N-dimethyl-2-(diphenylmethoxy)-
FAR 90X2
Histaxin
HSDB 3066
Hyadrine
Ibiodral
Medidryl
Mephadryl
N-(2-(Diphenylmethoxy)ethyl)-N,N-dimethylamine
N-(Benzhydryloksy-etylo)dwumetyloamina
Nausen
Novamina
O-Benzhydryldimethylaminoethanol
PM 255
Probedryl
Rigidyl
S51
Syntedril
ATC A04AB05
N01BX06
N04AB01
N05CM20
R06AA02
S01GX16
D04AA32
CID 3100
CAS 000058731
Drugbank ID DB01075
TTD Drug ID DAP000490
SMILES CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2
Formula C17H21NO
Molweight 255.355
Atoms 19
LogP 3.3542
Rotatable Bonds 6
H-Bond Donors 0
H-Bond Acceptors 2
CYP interactions
NameRelationsReferences
2D6Substrate Inhibitor umm
17020955
9616188
7853212
7980647
11270914
12678691
11270914
10824625
12678691
15718288
Transporter
AC-No.NameReferences
P78381SLC35A2 17686537
Extrarenal fraction 0.9
Elimination half-life 4h