Compounds

Type:
Unknown

AlogP:
3.11

Polar Surface Area:
88.16

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA4586232

Name:
4-[(R)-1-((R)-(S)-4-(S)-Methyl-8-methyl-13-oxo-3,14-dioxa-tricyclo[9.3.0.0(Show More⌵

Mol. Formula:
C27H36N2O4

M.W.:
452.60

Type:
Unknown

AlogP:
3.80

Polar Surface Area:
85.16

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4578286

Name:
(3R,3aS,9aR,10aR,10bS,E)-3-((4-hydroxy-4-phenylpiperidin-1-yl)methyl)-6,9a-Show More⌵

Mol. Formula:
C26H35NO4

M.W.:
425.57

Type:
Unknown

AlogP:
3.81

Polar Surface Area:
62.30

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4575683

Name:
(4S,12S,13R)-12-{[(R)-Cyclohexyl-(2-hydroxy-ethyl)-amino]-methyl}-8-(R)-metShow More⌵

Mol. Formula:
C23H37NO4

M.W.:
391.55

Type:
Unknown

AlogP:
3.45

Polar Surface Area:
62.30

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA4573004

Name:
(3R,3aS,9aR,10aR,10bS,E)-3-((ethyl(2-hydroxyethyl)amino)methyl)-6,9a-dimethShow More⌵

Mol. Formula:
C19H31NO4

M.W.:
337.46

7 activity values

Type:
Unknown

AlogP:
2.14

Polar Surface Area:
62.30

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA4572225

Name:
(3R,3aS,9aR,10aR,10bS,E)-6,9a-dimethyl-3-((methyl(phenethyl)amino)methyl)-3Show More⌵

Mol. Formula:
C24H33NO3

M.W.:
383.53

7 activity values

Type:
Unknown

AlogP:
4.00

Polar Surface Area:
42.07

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA4571375

Name:
(3R,3aS,9aR,10aR,10bS,E)-3-(((3,4-dimethoxybenzyl)(methyl)amino)methyl)-6,9Show More⌵

Mol. Formula:
C25H35NO5

M.W.:
429.56

7 activity values

Type:
Unknown

AlogP:
3.97

Polar Surface Area:
60.53

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA4562467

Name:
(3R,3aS,9aR,10aR,10bS,E)-3-((4-(6-hydroxy-2-methylpyrimidin-4-yl)piperidin-Show More⌵

Mol. Formula:
C25H35N3O4

M.W.:
441.57

20 activity values

4 unique targets

Type:
Unknown

AlogP:
3.51

Polar Surface Area:
88.08

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA4558295

Name:
(2R)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-Show More⌵

Mol. Formula:
C69H107N17O12S

M.W.:
1398.79

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4543784

Name:
(3R,3aS,9aR,10aR,10bS,E)-6,9a-dimethyl-3-((4-(pyridin-3-yloxy)piperidin-1-yShow More⌵

Mol. Formula:
C25H34N2O4

M.W.:
426.56

Type:
Unknown

AlogP:
3.76

Polar Surface Area:
64.19

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA4519090

Name:
(6R,12R)-12-{[(R)-1-Cyclopropylmethyl-((S)-isopropyl)-amino]-methyl}-4,8-diShow More⌵

Mol. Formula:
C22H35NO3

M.W.:
361.53

Type:
Unknown

AlogP:
3.94

Polar Surface Area:
42.07

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA4483082

Name:
(3R,3aS,9aR,10aR,10bS,E)-3-((((1-ethyl-1H-pyrazol-4-yl)methyl)(isopropyl)amShow More⌵

Mol. Formula:
C24H37N3O3

M.W.:
415.58

Type:
Unknown

AlogP:
3.95

Polar Surface Area:
59.89

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA4470351

Name:
(3R,3aS,9aR,10aR,10bS,E)-6,9a-dimethyl-3-((4-(pyridin-3-ylmethoxy)piperidinShow More⌵

Mol. Formula:
C26H36N2O4

M.W.:
440.58