Compound - Results

Practolol

Java required.


Information Structure
Name Practolol
Synonyms
1-(4-Acetamidophenoxy)-3-isopropylamino-2-propanol
4-(2-Hydroxy-3-(isopropylamino)propoxy)acetanilide
AY 21011
CCRIS 1089
Dalzic
EINECS 229-712-1
Eraldin
ICI 50172
N-(4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)acetamide
Practolol
Practololo
Practololum
Praktololu
Teranol
ATC C07AB01
CID 443371
CAS 006673354
TTD Drug ID DAP000940
SMILES CC(C)NC[C@@H](O)COC1=CC=C(NC(C)=O)C=C1
Formula C14H22N2O3
Molweight 266.336
Atoms 20
LogP 1.8466
Rotatable Bonds 8
H-Bond Donors 0
H-Bond Acceptors 5
Metoprolol

Java required.


Information Structure
Name Metoprolol
Synonyms
(RS)-Metoprolol
1-(Isopropylamino)-3-(p-(2-methoxyethyl)phenoxy)-2-propanol
Beatrolol
CCRIS 4198
CGP 2175
dl-Metoprolol
EINECS 253-483-7
Metoprolol
Metoprololum
Preblok
Presolol
Spesicor
ATC C07AB02
CID 4171
CAS 037350586
Drugbank ID DB00264
TTD Drug ID DAP000481
SMILES COCCC1=CC=C(OC[C@H](O)CNC(C)C)C=C1
Formula C15H25NO3
Molweight 267.364
Atoms 19
LogP 2.0041
Rotatable Bonds 9
H-Bond Donors 0
H-Bond Acceptors 4
CYP interactions
NameRelationsReferences
2C19Substrate 11996015
2D6Substrate Inhibitor 11038161
10575324
9681670
10709776
11038161
16176119
9143866
Extrarenal fraction 0.8
Elimination half-life 5h
Atenolol

Java required.


Information Structure
Name Atenolol
Synonyms
1-p-Carbamoylmethylphenoxy-3-isopropylamino-2-propanol
2-(4-(2-Hydroxy-3-isopropylaminopropoxy)phenyl)acetamid
2-(p-(2-Hydroxy-3-(isopropylamino)propoxy)phenyl)acetamide
4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzeneacetamide
Aircrit
Alinor
Altol
Anselol
Antipressan
Apo-Atenolol
Atcardil
Atecard
Atehexal
Atenblock
Atendol
Atenet
Ateni
Atenil
Atenol 1A Pharma
Atenol Acis
Atenol AL
Atenol Atid
Atenol Cophar
Atenol Ct
Atenol Fecofar
Atenol Gador
Atenol Genericon
Atenol GNR
Atenol Heumann
Atenol MSD
Atenol NM Pharma
Atenol Nordic
Atenol PB
Atenol Quesada
Atenol Stada
Atenol Tika
Atenol Trom
Atenol Von Ct
Atenol-Mepha
Atenol-ratiopharm
Atenol-Wolff
Atenolin
Atenolol
Atenololum
Atenomel
Atereal
Aterol
Betablok
Betacard
Betasyn
Betatop Ge
Blocotenol
Blokium
BRN 2739235
Cardaxen
Cardiopress
CCRIS 4196
Corotenol
Cuxanorm
Duraatenolol
duratenol
EINECS 249-451-7
Evitocor
Farnormin
Felo-Bits
Hipres
HSDB 6526
Hypoten
Ibinolo
ICI 66,082
ICI 66082
Internolol
Jenatenol
Juvental
Lo-ten
Loten
Lotenal
Myocord
Normalol
Normiten
Noten
Oraday
Ormidol
Panapres
Plenacor
Premorine
Prenolol
Prenormine
Prinorm
Scheinpharm Atenol
Seles Beta
Selobloc
Serten
Servitenol
Stermin
Tenidon
Tenobloc
Tenoblock
Tenolol
Tenoprin
Tenormin
Tenormine
Tensimin
Tredol
Unibloc
Uniloc
Vascoten
Vericordin
Wesipin
Xaten
ATC C07AB03
CID 2249
CAS 029122687
Drugbank ID DB00335
TTD Drug ID DAP000482
SMILES CC(C)NC[C@@H](O)COC1=CC=C(CC(N)=O)C=C1
Formula C14H22N2O3
Molweight 266.336
Atoms 19
LogP 1.5433
Rotatable Bonds 8
H-Bond Donors 0
H-Bond Acceptors 5
CYP interactions
NameRelationsReferences
3A4Substrate 27019
Extrarenal fraction 0.12
Elimination half-life 6h
Acebutolol

Java required.


Information Structure
Name Acebutolol
Synonyms
(+-)-3-Acetyl-4-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide
(+-)-Acebutolol
(+-)-N-(3-Acetyl-4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)butanamide
1-(2-Acetyl-4-n-butyramidophenoxy)-2-hydroxy-3-isopropylaminopropane
3-(Acetyl-4-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide
3-Acetyl-4-(2-hydroxy-3-isopropylaminopropoxy)butyranilid
5-Butyramido-2-(2-hydroxy-3-isopropylaminopropoxy)acetophenone
Acebrutololum
Acebutolol
Acebutololo
Acebutololum
Acetobutolol
BRN 2162244
dl-Acebutolol
EINECS 253-539-0
HSDB 6524
Neptal
Prent
RP 21823
ATC C07AB04
CID 1978
CAS 037517309
Drugbank ID DB01193
TTD Drug ID DAP000484
SMILES CCCC(=O)NC1=CC(C(C)=O)=C(OC[C@@H](O)CNC(C)C)C=C1
Formula C18H28N2O4
Molweight 336.426
Atoms 24
LogP 2.8294
Rotatable Bonds 11
H-Bond Donors 0
H-Bond Acceptors 6
CYP interactions
NameRelationsReferences
2D6Inhibitor umm
Transporter
AC-No.NameReferences
P46721Solute carrier organic anion transporter family member 1A221039758
Extrarenal fraction 0.8
Elimination half-life 9h
Betaxolol

Java required.


Information Structure
Name Betaxolol
Synonyms
1-(4-(2-(Cyclopropylmethoxy)ethyl)phenoxy)-3-((1-methylethyl)amino)-2-propanol
Betaxolol
Betaxololum
ATC C07AB05
S01ED02
CID 2369
CAS 063659187
Drugbank ID DB00195
TTD Drug ID DAP000305
SMILES CC(C)NC[C@H](O)COC1=CC=C(CCOC[C@H]2CC2)C=C1
Formula C18H29NO3
Molweight 307.428
Atoms 22
LogP 2.7843
Rotatable Bonds 11
H-Bond Donors 0
H-Bond Acceptors 4
CYP interactions
NameRelationsReferences
1A2Substrate umm
2D6Substrate Inhibitor 17635183
umm
1675413
Transporter
AC-No.NameReferences
P46721Solute carrier organic anion transporter family member 1A221039758
Extrarenal fraction 0.8
Elimination half-life 18h
Bevantolol

Java required.


Information Structure
Name Bevantolol
Synonyms
1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-2-propanol
Bevantolol
Bevantololum
BRN 2769444
ATC C07AB06
CID 2372
CAS 059170239
Drugbank ID DB01295
TTD Drug ID DAP000897
SMILES COC1=C(OC)C=C(CCNC[C@H](O)COC2=CC=CC(C)=C2)C=C1
Formula C20H27NO4
Molweight 345.433
Atoms 25
LogP 2.9751
Rotatable Bonds 10
H-Bond Donors 0
H-Bond Acceptors 5
Transporter
AC-No.NameReferences
P46721Solute carrier organic anion transporter family member 1A221039758
Bisoprolol

Java required.


Information Structure
Name Bisoprolol
Synonyms
(+-)-1-((alpha-(2-Isopropoxyethoxy)-p-tolyl)oxy)-3-(isopropylamino)-2-propanol
Bisoprolol
Bisoprololum
CL 297,939
EMD 33 512
ATC C07AB07
CID 2405
CAS 066722449
Drugbank ID DB00612
TTD Drug ID DAP000483
SMILES CC(C)NC[C@@H](O)COC1=CC=C(COCCOC(C)C)C=C1
Formula C18H31NO4
Molweight 325.443
Atoms 23
LogP 2.7568
Rotatable Bonds 12
H-Bond Donors 0
H-Bond Acceptors 5
CYP interactions
NameRelationsReferences
2D6Substrate 14732961
9763205
3A4Substrate umm
9763205
Transporter
AC-No.NameReferences
P46721Solute carrier organic anion transporter family member 1A221039758
Extrarenal fraction 0.48
Elimination half-life 11h
Celiprolol

Java required.


Information Structure
Name Celiprolol
Synonyms
BRN 2776298
CCRIS 3400
Celiprolol
Celiprololum
Celiptolol
EINECS 260-497-7
N-(3-Acetyl-4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N,N-diethylurea
Selectol
ATC C07AB08
CID 2663
CAS 056980939
SMILES CCN(CC)C(=O)NC1=CC(C(C)=O)=C(OC[C@@H](O)CNC(C)(C)C)C=C1
Formula C20H33N3O4
Molweight 379.494
Atoms 27
LogP 3.3546
Rotatable Bonds 12
H-Bond Donors 0
H-Bond Acceptors 6
Transporter
AC-No.NameReferences
P46721OATP119067419
Extrarenal fraction 0.6
Elimination half-life 7h
Esmolol

Java required.


Information Structure
Name Esmolol
Synonyms
(+-)-Esmolol
ASL 8052-001
BRN 5287174
Esmolol
HSDB 6535
Methyl 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)benzenepropanoate
ATC C07AB09
CID 59768
CAS 081147924
Drugbank ID DB00187
TTD Drug ID DAP000304
SMILES COC(=O)CCC1=CC=C(OC[C@H](O)CNCC(C)C)C=C1
Formula C16H25NO4
Molweight 295.374
Atoms 21
LogP 1.9208
Rotatable Bonds 10
H-Bond Donors 0
H-Bond Acceptors 5
Transporter
AC-No.NameReferences
P46721OATP119067419
Extrarenal fraction 0.99
Elimination half-life 9 min
Epanolol

Java required.


Information Structure
Name Epanolol
Synonyms
Epanolol
Epanololum
Ici 141292
ATC C07AB10
CID 72014
CAS 086880515
SMILES O[C@@H](CNCCNC(=O)CC1=CC=C(O)C=C1)COC2=CC=CC=C2C#N
Formula C20H23N3O4
Molweight 369.414
Atoms 27
LogP 1.73388
Rotatable Bonds 11
H-Bond Donors 0
H-Bond Acceptors 7
Transporter
AC-No.NameReferences
P46721OATP119067419
S-atenolol

Java required.


Information Structure
Name S-atenolol
Synonyms
(-)-Atenolol
(S)-4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzeneacetamide
2-(p-((2S)-2-Hydroxy-3-(isopropylamino)propoxy)phenyl)acetamide
Atenolol
Esatenolol
S-(-)-4-(2-Hydroxy-3-isopropylaminopropoxy)phenylacetamide
S-Atenolol
ATC C07AB11
CID 175540
CAS 093379545
SMILES CC(C)NC[C@H](O)COC1=CC=C(CC(N)=O)C=C1
Formula C14H22N2O3
Molweight 266.336
Atoms 20
LogP 1.5433
Rotatable Bonds 8
H-Bond Donors 0
H-Bond Acceptors 5
Transporter
AC-No.NameReferences
P46721OATP119067419
Nebivolol

Java required.


Information Structure
Name Nebivolol
Synonyms
Alpha,alpha-(Iminodimethylene)bis(6-fluoro-2-chromanmethanol)
Nebivolol
Nebivololum
R65,824
ATC C07AB12
CID 71301
CAS 099200096
Drugbank ID DB04861
TTD Drug ID DAP000942
SMILES O[C@@H](CNC[C@@H](O)[C@@H]1CCC2=C(O1)C=CC(F)=C2)[C@H]3CCC4=CC(F)=CC=C4O3
Formula C22H25F2NO4
Molweight 405.435
Atoms 29
LogP 2.7545
Rotatable Bonds 6
H-Bond Donors 0
H-Bond Acceptors 7
CYP interactions
NameRelationsReferences
2D6Substrate 17094780
Transporter
AC-No.NameReferences
P46721OATP119067419
Extrarenal fraction 0.95
Elimination half-life 8h
Talinolol

Java required.


Information Structure
Name Talinolol
Synonyms
N-Cyclohexyl-N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)urea
Talinolol
ATC C07AB13
CID 68770
CAS 038649739
SMILES CC(C)(C)NC[C@@H](O)COC1=CC=C(NC(=O)N[C@@H]2CCCCC2)C=C1
Formula C20H33N3O3
Molweight 363.494
Atoms 26
LogP 4.1234
Rotatable Bonds 10
H-Bond Donors 0
H-Bond Acceptors 6
CYP interactions
NameRelationsReferences
3A4Substrate 11835190
Transporter
AC-No.NameReferences
P08183Multidrug resistance protein 112948010
P46059Peptide transporter 118782614
P46721OATP119779132
Q92887Canalicular multispecific organic anion transporter 117468862