Compound - Results

Methohexital

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Information Structure
Name Methohexital
Synonyms
(+-)-5-Allyl-1-methyl-5-(1-methyl-2-pentynyl)barbituric Acid
5-Allyl-5-(3-hexyn-2-yl)-1-methylbarbituric Acid
Brevital
Brietal
Compound 22451
Compound 25398
EINECS 205-798-6
Enallynymall
Enallynymalum
Methodrexitone
Methohexital
Methohexitalum
Methohexitone
Metoesital
Metohexital
ATC N01AF01
N05CA15
CID 9034
CAS 000151837
Drugbank ID DB00474
TTD Drug ID DAP000677
SMILES CCC#C[C@@H](C)[C@@]1(CC=C)C(=O)NC(=O)N(C)C1=O
Formula C14H18N2O3
Molweight 262.304
Atoms 19
LogP 1.5733
Rotatable Bonds 3
H-Bond Donors 0
H-Bond Acceptors 4
Extrarenal fraction 1
Elimination half-life 1.5h
Hexobarbital

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Information Structure
Name Hexobarbital
Synonyms
1,5-Dimethyl-5-(1-cyclohexenyl)barbituric Acid
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-1,5-dimethyl-
5-(1-Cyclohexen-1-yl)-1,5-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
5-(1-Cyclohexen-1-yl)-1,5-dimethylbarbituric Acid
5-(1-Cyclohexenyl-1)-1-methyl-5-methylbarbituric Acid
5-(delta-1,2-Cyclohexenyl)-5-methyl-N-methyl-barbitursaeure
AI3-61892
Barbidorm
Citodon
Citopan
Cyclonal
Cyclopan
Dorico
EINECS 200-264-9
Enhexymal
Enhexymalum
Esobarbitale
Evipal
Evipan
Hexabarbital
Hexanastab Oral
Hexenal
Hexenal (barbiturate)
Hexobarbital
Hexobarbital (VAN)
Hexobarbitalum
Hexobarbitone
Hexobarbitonum
Methexenyl
Methylhexabarbital
Methylhexabital
N-Methyl-5-cyclohexenyl-5-methylbarbituric Acid
Narcosan
Noctivane
NSC 71929
Sombucaps
Sombulex
Somnalert
ATC N01AF02
N05CA16
CID 3608
CAS 000056291
TTD Drug ID DAP000688
SMILES CN1C(O)=NC(=O)[C@@](C)(C2=CCCCC2)C1=O
Formula C12H16N2O3
Molweight 236.267
Atoms 17
LogP 1.468
Rotatable Bonds 1
H-Bond Donors 0
H-Bond Acceptors 4
CYP interactions
NameRelationsReferences
1A2Substrate 7895609
2C9Substrate 11996015
2C19Substrate 17487889
3A4Substrate 7895609
Thiopental

Java required.


Information Structure
Name Thiopental
Synonyms
(+-)-Thiopental
2-Thio-5-ethyl-5-sec-pentylbarbituric Acid
5-24-09-00172 (Beilstein Handbook Reference)
5-Ethyl-5-(1-methylbutyl)-2-thiobarbituric Acid
BRN 0209361
EINECS 200-984-3
Intraval
Penthiobarbital
Pentothiobarbital
Thiomebumal
Thionembutal
Thiopental
Thiopentobarbital
Thiopentobarbitone
Thiopentobarbituric Acid
Thiopentone
Thiothal
Tiopentale
ATC N01AF03
N05CA19
CID 3000715
CAS 000076755
Drugbank ID DB00599
TTD Drug ID DAP000661
SMILES CCC[C@@H](C)[C@]1(CC)C(=O)NC(S)=NC1=O
Formula C11H18N2O2S
Molweight 242.338
Atoms 16
LogP 2.0075
Rotatable Bonds 4
H-Bond Donors 0
H-Bond Acceptors 4
CYP interactions
NameRelationsReferences
2E1Inhibitor 9784924
3A4Inhibitor 9784924
Extrarenal fraction 1
Elimination half-life 10h