ID: ALA2146346
Type: SINGLE PROTEIN
Synonyms: hN1 | Neurogenic locus notch homolog protein 1 | NEXT | NICD | Notch 1 | Notch 1 extracellular truncation | Notch 1 intracellular domain | NOTCH1 | TAN1 | Translocation-associated notch protein TAN-1
Organism: Homo sapiens
Species Group: Homo sapiens
Protein Target Classification: Membrane receptor
ALA ID | Relationship | Pref Name | Target Type |
---|---|---|---|
ALA4524007 | SUBSET OF | Notch receptor | PROTEIN FAMILY |
Description | Relationship | Accession |
---|---|---|
Neurogenic locus notch homolog protein 1 | PROTEIN | P46531 |
Name:
(2R,3R)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-(3-(trifluoromethyl)phenyl)-2-(3,3,3-trifluoropropyl)succinamide
Mol. Formula:
C30H26F6N4O3
M.W.:
604.55
Type:
Small molecule
AlogP:
5.19
Polar Surface Area:
104.86
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.35
Name:
(2R,3R)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-(3-(trifluoromethoxy)phenyl)-2-(3,3,3-trifluoropropyl)succinamide
Mol. Formula:
C30H26F6N4O4
M.W.:
620.55
Type:
Small molecule
AlogP:
5.07
Polar Surface Area:
114.09
HBA:
5
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.33
Name:
(2R,3R)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-(3-(methylsulfonyl)phenyl)-2-(3,3,3-trifluoropropyl)succinamide
Mol. Formula:
C30H29F3N4O5S
M.W.:
614.65
Type:
Small molecule
AlogP:
3.57
Polar Surface Area:
139.00
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.38
Name:
(2R,3R)-3-(4-methoxyphenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide
Mol. Formula:
C30H29F3N4O4
M.W.:
566.58
Type:
Small molecule
AlogP:
4.18
Polar Surface Area:
114.09
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.40
Name:
(2R,3R)-3-(4-fluorophenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide
Mol. Formula:
C29H26F4N4O3
M.W.:
554.54
Type:
Small molecule
AlogP:
4.31
Polar Surface Area:
104.86
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.41
Name:
(2R,3R)-3-(3,4-difluorophenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide
Mol. Formula:
C29H25F5N4O3
M.W.:
572.53
Type:
Small molecule
AlogP:
4.45
Polar Surface Area:
104.86
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
Name:
(2R,3R)-3-(2,4-difluorophenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide
Mol. Formula:
C29H25F5N4O3
M.W.:
572.53
Type:
Small molecule
AlogP:
4.45
Polar Surface Area:
104.86
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39
Name:
(2R,3R)-3-(3,5-difluorophenyl)-N1-((S,Z)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-2-(3,3,3-trifluoropropyl)succinamide
Mol. Formula:
C29H25F5N4O3
M.W.:
572.53
Type:
Small molecule
AlogP:
4.45
Polar Surface Area:
104.86
HBA:
4
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.39