Compounds

Type:
---

AlogP:
3.91

Polar Surface Area:
64.99

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA5198450

Name:

Mol. Formula:
C20H26N2O4S

M.W.:
390.51

Type:
---

AlogP:
3.78

Polar Surface Area:
60.36

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA5196562

Name:

Mol. Formula:
C23H30N2O5

M.W.:
414.50

6 activity values

Type:
---

AlogP:
3.72

Polar Surface Area:
69.59

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA5196101

Name:
(Z)-10b-(4-hydroxybut-2-en-2-yl)-3,3-dimethyl-4a,5-dihydronaphtho[2,1-e][1,Show More⌵

Mol. Formula:
C17H20O5

M.W.:
304.34

Type:
---

AlogP:
2.49

Polar Surface Area:
64.99

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA5205464

Name:

Mol. Formula:
C22H27N3O6

M.W.:
429.47

Type:
---

AlogP:
3.62

Polar Surface Area:
103.50

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA5204948

Name:

Mol. Formula:
C28H30N2O4

M.W.:
458.56

11 activity values

Type:
---

AlogP:
5.11

Polar Surface Area:
60.36

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA5202990

Name:
2-(4-(1-(1,2,5-trioxaspiro[5.5]undecan-3-yl)vinyl)naphthalen-1-yloxy)ethanoShow More⌵

Mol. Formula:
C22H26O5

M.W.:
370.45

Type:
---

AlogP:
4.23

Polar Surface Area:
57.15

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA5200738

Name:
2-(4-(1-(6,7,10-trioxaspiro[4.5]decan-8-yl)vinyl)naphthalen-1-yloxy)-2-methShow More⌵

Mol. Formula:
C23H28O5

M.W.:
384.47

Type:
---

AlogP:
4.62

Polar Surface Area:
57.15

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.76

DETAILS

ALA5208910

Name:

Mol. Formula:
C20H30N2O4

M.W.:
362.47

6 activity values

Type:
---

AlogP:
3.61

Polar Surface Area:
60.36

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA5208794

Name:
2-(4-(1-(3,3-dimethyl-1,2,4-trioxan-6-yl)vinyl)naphthalen-1-yloxy)ethanol

Mol. Formula:
C19H22O5

M.W.:
330.38

Type:
---

AlogP:
3.31

Polar Surface Area:
57.15

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA5207472

Name:
2-(4-(1-(3,3-dimethyl-1,2,4-trioxan-6-yl)vinyl)naphthalen-1-yloxy)-2-methylShow More⌵

Mol. Formula:
C21H26O5

M.W.:
358.43

Type:
---

AlogP:
4.09

Polar Surface Area:
57.15

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.82

DETAILS

ALA5206511

Name:
(Z)-10b'-(4-hydroxybut-2-en-2-yl)-4a',5'-dihydrospiro[cyclohexane-1,3'-naphShow More⌵

Mol. Formula:
C20H24O5

M.W.:
344.41

Type:
---

AlogP:
3.41

Polar Surface Area:
64.99

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5195921

Name:

Mol. Formula:
C20H26N2O5

M.W.:
374.44

Type:
---

AlogP:
3.31

Polar Surface Area:
73.50

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA5195209

Name:
2-{[4-(1-{spiro[adamantane-2,2'-[1,3,4]trioxan]-5'-yl}ethenyl)naphthalen-1-Show More⌵

Mol. Formula:
C26H30O5

M.W.:
422.52

Type:
---

AlogP:
4.72

Polar Surface Area:
57.15

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA5191986

Name:

Mol. Formula:
C21H32N2O4

M.W.:
376.50

Type:
---

AlogP:
4.00

Polar Surface Area:
60.36

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA5190827

Name:
(4-(1-(6,7,10-trioxaspiro[4.5]decan-8-yl)vinyl)naphthalen-1-yloxy)(tert-butShow More⌵

Mol. Formula:
C25H34O4Si

M.W.:
426.63

2 activity values

Type:
---

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA5190539

Name:
tert-butyl(4-(1-(3,3-dimethyl-1,2,4-trioxan-6-yl)vinyl)naphthalen-1-yloxy)dShow More⌵

Mol. Formula:
C23H32O4Si

M.W.:
400.59

2 activity values

Type:
---

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA5188497

Name:
(4-(1-(1,2,5-trioxaspiro[5.5]undecan-3-yl)vinyl)naphthalen-1-yloxy)(tert-buShow More⌵

Mol. Formula:
C26H36O4Si

M.W.:
440.66

2 activity values

Type:
---

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA5186484

Name:
2-(4-(1-(1,2,5-trioxaspiro[5.5]undecan-3-yl)vinyl)naphthalen-1-yloxy)-2-metShow More⌵

Mol. Formula:
C24H30O5

M.W.:
398.50