Compounds

ALA5272715

Name:
Ethylene glycol (4-(4-chloro)benzyloxyphenyl) cyclohexylaminoethyl ether

Mol. Formula:
C23H30ClNO3

M.W.:
403.95

Type:
---

AlogP:
5.24

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5272228

Name:
2-((4-(2-(2-(cyclopentylamino)ethoxy)cyclobutoxy)phenoxy)methyl)aniline

Mol. Formula:
C22H30N2O3

M.W.:
370.49

Type:
---

AlogP:
3.78

Polar Surface Area:
65.74

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5272084

Name:
N-(2-(2-(4-(benzyloxy)phenoxy)ethoxy)ethyl)cyclopentanamine

Mol. Formula:
C22H29NO3

M.W.:
355.48

Type:
---

AlogP:
4.19

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA5270304

Name:
Ethylene glycol (4-(4-nitro)benzyloxyphenyl) cyclopentylaminoethyl ether

Mol. Formula:
C22H28N2O5

M.W.:
400.48

Type:
---

AlogP:
4.10

Polar Surface Area:
82.86

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA5270274

Name:
Ethylene glycol (4-(4-benzyloxy)benzyloxyphenyl) cyclohexylaminoethyl ether

Mol. Formula:
C30H37NO4

M.W.:
475.63

Type:
---

AlogP:
6.16

Polar Surface Area:
48.95

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA5269470

Name:
Ethylene glycol (4-(3-amine)benzyloxyphenyl) cyclopentylaminoethyl ether

Mol. Formula:
C22H30N2O3

M.W.:
370.49

Type:
---

AlogP:
3.78

Polar Surface Area:
65.74

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5269019

Name:
Ethylene glycol (4-(2-nitro)benzyloxyphenyl) cyclohexylaminoethyl ether

Mol. Formula:
C23H30N2O5

M.W.:
414.50

Type:
---

AlogP:
4.49

Polar Surface Area:
82.86

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA5268794

Name:
Ethylene glycol (4-(1H-1,2,4-triazolyl)phenyl)cyclopentylaminoethyl ether

Mol. Formula:
C17H24N4O2

M.W.:
316.40

Type:
---

AlogP:
2.19

Polar Surface Area:
61.20

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA5268783

Name:
Ethylene glycol (4-ethyloxyphenyl) cyclopentylaminoethyl ether

Mol. Formula:
C17H27NO3

M.W.:
293.41

Type:
---

AlogP:
3.01

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA5267942

Name:
2-((4-(2-(2-(cyclopentylamino)ethoxy)ethoxy)phenoxy)methyl)benzoic acid

Mol. Formula:
C23H29NO5

M.W.:
399.49

Type:
---

AlogP:
3.89

Polar Surface Area:
77.02

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA5267818

Name:
1-(diaminomethylene)-2-(2-furylmethyl)guanidine

Mol. Formula:
C7H11N5O

M.W.:
181.20

Type:
---

AlogP:
-0.63

Polar Surface Area:
115.92

HBA:
2

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA5282355

Name:
((4-(5-(3-amino-1-(2-amino-3-(3,4-dichlorophenyl)propanamido)-3-oxopropyl)-Show More⌵

Mol. Formula:
C40H40Cl2F2N6O6

M.W.:
809.70

Type:
---

AlogP:
5.87

Polar Surface Area:
171.87

HBA:
10

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
17

Passes Ro3:
N

QED Weighted:
0.10

DETAILS

ALA5279317

Name:
Ethylene glycol (4-benzyloxyphenyl) cyclopropylaminoethyl ether

Mol. Formula:
C20H25NO3

M.W.:
327.42

Type:
---

AlogP:
3.41

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA5279249

Name:
Ethylene glycol (4-(4-amine)benzyloxyphenyl) cyclopentylaminoethyl ether

Mol. Formula:
C22H30N2O3

M.W.:
370.49

Type:
---

AlogP:
3.78

Polar Surface Area:
65.74

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5277149

Name:
3-((4-(2-(2-(cyclopentylamino)ethoxy)ethoxy)phenoxy)methyl)benzoic acid

Mol. Formula:
C23H29NO5

M.W.:
399.49

Type:
---

AlogP:
3.89

Polar Surface Area:
77.02

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA5276885

Name:
Ethylene glycol (4-benzyloxyphenyl) cycloheptylaminoethyl ether

Mol. Formula:
C24H33NO3

M.W.:
383.53

Type:
---

AlogP:
4.97

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5276615

Name:
2-((4-(2-(2-(cyclopentylamino)ethoxy)ethoxy)phenoxy)methyl)methylbenzoate

Mol. Formula:
C24H31NO5

M.W.:
413.51

Type:
---

AlogP:
3.98

Polar Surface Area:
66.02

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA5276597

Name:
Ethylene glycol (4-benzyloxyphenyl) cyclobutylaminoethyl ether

Mol. Formula:
C21H27NO3

M.W.:
341.45

Type:
---

AlogP:
3.80

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA5276450

Name:
Ethylene glycol (4-(4-methyl)benzyloxyphenyl) cyclopentylaminoethyl ether

Mol. Formula:
C23H31NO3

M.W.:
369.51

Type:
---

AlogP:
4.50

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA5276133

Name:
Ethylene glycol (4-benzyloxyphenyl) (3-pyrrolyl)aminoethyl ether

Mol. Formula:
C21H24N2O3

M.W.:
352.43

Type:
---

AlogP:
4.10

Polar Surface Area:
55.51

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.51

DETAILS