| Name | betaxolol |
|---|
| Molecular formula | C18H29NO3 |
|---|
| IUPAC name | 1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol |
|---|
| Molecular weight | 307.434 |
|---|
| Hydrogen bond acceptor | 4 |
|---|
| Hydrogen bond donor | 2 |
|---|
| XlogP | 2.8 |
|---|
| Synonyms | BDBM50405521
Tox21_110091
Betaxolol [INN:BAN]
BPBio1_000621
CC-24642
D07526
GTPL549
Kerlone (TN)
1-(isopropylamino)-3-[p-(cyclopropylmethoxyethyl)phenoxy]-2-propanol
MRF-0000336
NCGC00024863-04
AC1L1DIZ
SC-23071
SL-75212
Betaxolol (Betoptic)
Betazolol
BSPBio_000563
DSSTox_CID_2674
HY-B0381
(.+/-.)-1-[p-[2-(Cyclopropylmethoxy)ethyl]phenoxy]-3-(isopropylamino)-2-propanol
L000125
1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-(propan-2-ylamino)-2-propanol
NCGC00015159-06
63659-19-8 (hydrochloride)
Prestwick1_000382
ALO-1401-02
AS-14125
SW196917-5
Betaxolol HCL
Betoptic S
C18H29NO3
CTK8F0838
DTXSID2022674
KERLEDEX
1-(4-(2-(cyclopropylmethoxy)ethyl)phenoxy)-3-(isopropylamino)propan-2-ol
LS-122005
2-Propanol, 1-(4-(2-(cyclopropylmethoxy)ethyl)phenoxy)-3-((1-methylethyl)amino)-
NCGC00015159-11
AB2000495
Q-200713
SCHEMBL23530
beta-Xolol
Tox21_110091_1
Betaxololum
BRD-A02759312-003-03-9
CCG-204288
HMS2089I07
KM0772
1-[(4-{2-[(cyclopropylmethyl)oxy]ethyl}phenyl)oxy]-3-[(1-methylethyl)amino]propan-2-ol
NCGC00015159-04
NWIUTZDMDHAVTP-UHFFFAOYSA-N
AK546815
SL-75212-10
Betaxolol (INN)
Betoptic
C-19113
CHEMBL423
DSSTox_GSID_22674
I14-16995
(3-{4-[2-(cyclopropylmethoxy)ethyl]phenoxy}-2-hydroxypropyl)(propan-2-yl)amine
Lokren (TN)
1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol
NCGC00015159-08
659X187
Prestwick2_000382
AN-1136
BC227945
TC-030604
Betaxolol S
Betoptic S (TN)
CAS-63659-18-7
D03ROX
FT-0601531
Kerlone
1-(4-[2-(Cyclopropylmethoxy)ethyl]phenoxy)-3-(isopropylamino)-2-propanol #
MolPort-003-845-027
2-Propanol,1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-[(1-methylethyl)amino]-
NCGC00024863-03
AC-1115
s2091
SL 75212
Betaxololum [INN-Latin]
BRD-A02759312-003-11-2
CHEBI:3082
DB00195
HMS3655P17
(+/-)-1-[p-[2-(Cyclopropylmethoxy)ethyl]phenoxy]-3-(isopropylamino)-2-propanol
KS-00001F72
1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-(isopropylamino)propan-2-ol
NCGC00015159-05
63659-18-7
Prestwick0_000382
AKOS015841671
API0024704
SPBio_002484
Betaxolol (TN)
Betoptic (TN)
C06849
CS-2452
DSSTox_RID_76685
K005
1-(4-(2-(Cyclopropylmethoxy)ethyl)phenoxy)-3-((1-methylethyl)amino)-2-propanol
Lopac0_000193
1-{4-[2-(cyclopropylmethoxy)ethyl]phenoxy}-3-(propan-2-ylamino)propan-2-ol
NCGC00015159-09
A834454
Prestwick3_000382 [ Show all ] |
|---|
| Inchi Key | NWIUTZDMDHAVTP-UHFFFAOYSA-N |
|---|
| Inchi ID | InChI=1S/C18H29NO3/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3 |
|---|
| PubChem CID | 2369 |
|---|
| ChEMBL | CHEMBL423 |
|---|
| IUPHAR | 549 |
|---|
| BindingDB | 50405521 |
|---|
| DrugBank | DB00195 |
|---|
Structure SDF download |  |
|---|
| Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
|---|
zhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218