Compounds

Type:
Small molecule

AlogP:
3.12

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA2269718

Name:
3-(2-chlorophenyl)-5-(propan-2-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C12H10ClNO3

M.W.:
251.67

Type:
Small molecule

AlogP:
3.12

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA2269717

Name:
3-(3,4-dichlorophenyl)-5-(propan-2-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C12H9Cl2NO3

M.W.:
286.11

9 activity values

Type:
Small molecule

AlogP:
3.77

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA2269716

Name:
3-(2,4-dichlorophenyl)-5-(propan-2-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C12H9Cl2NO3

M.W.:
286.11

9 activity values

Type:
Small molecule

AlogP:
3.77

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA2269715

Name:
3-(4-chlorophenyl)-5-(propan-2-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C12H10ClNO3

M.W.:
251.67

17 activity values

Type:
Small molecule

AlogP:
3.12

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA2269714

Name:
5-(propan-2-ylidene)-3-(2,4,6-trichlorophenyl)oxazolidine-2,4-dione

Mol. Formula:
C12H8Cl3NO3

M.W.:
320.56

Type:
Small molecule

AlogP:
4.42

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA2269713

Name:
3-(3,5-dichlorophenyl)-5-(propan-2-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C12H9Cl2NO3

M.W.:
286.11

Type:
Small molecule

AlogP:
3.77

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA2269712

Name:
3-(3,5-dichlorophenyl)-5-methyl-5-(prop-1-en-2-yl)oxazolidine-2,4-dione

Mol. Formula:
C13H11Cl2NO3

M.W.:
300.14

Type:
Small molecule

AlogP:
3.81

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA2269711

Name:
3-(4-fluorophenyl)-5-(propan-2-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C12H10FNO3

M.W.:
235.21

Type:
Small molecule

AlogP:
2.60

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
Y

QED Weighted:
0.70

DETAILS

ALA2269710

Name:
5-(butan-2-ylidene)-3-(4-chlorophenyl)oxazolidine-2,4-dione

Mol. Formula:
C13H12ClNO3

M.W.:
265.70

Type:
Small molecule

AlogP:
3.51

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA2269709

Name:
5-(butan-2-ylidene)-3-(4-fluorophenyl)oxazolidine-2,4-dione

Mol. Formula:
C13H12FNO3

M.W.:
249.24

Type:
Small molecule

AlogP:
2.99

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
Y

QED Weighted:
0.76

DETAILS

ALA2269708

Name:
3-(4-chlorophenyl)-5-(hexan-2-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C15H16ClNO3

M.W.:
293.75

Type:
Small molecule

AlogP:
4.29

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA2269707

Name:
3-(4-chlorophenyl)-5-(octan-2-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C17H20ClNO3

M.W.:
321.80

Type:
Small molecule

AlogP:
5.07

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA2269706

Name:
3-(4-chlorophenyl)-5-(pentan-3-ylidene)oxazolidine-2,4-dione

Mol. Formula:
C14H14ClNO3

M.W.:
279.72

Type:
Small molecule

AlogP:
3.90

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA2269705

Name:
3-(4-chlorophenyl)-5-cyclohexylideneoxazolidine-2,4-dione

Mol. Formula:
C15H14ClNO3

M.W.:
291.73

Type:
Small molecule

AlogP:
4.04

Polar Surface Area:
46.61

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA2269704

Name:
3-(4-chloro-2-fluoro-5-hydroxyphenyl)-5-isopropylidene-1,3-oxazolidine-2,4-Show More⌵

Mol. Formula:
C12H9ClFNO4

M.W.:
285.66

Type:
Small molecule

AlogP:
2.96

Polar Surface Area:
66.84

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.81

DETAILS

ALA2269703

Name:
3-(4-chloro-2-fluoro-5-methoxyphenyl)-5-(propan-2-ylidene)oxazolidine-2,4-dShow More⌵

Mol. Formula:
C13H11ClFNO4

M.W.:
299.69

Type:
Small molecule

AlogP:
3.26

Polar Surface Area:
55.84

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA2269702

Name:
3-(4-chloro-5-ethoxy-2-fluorophenyl)-5-(propan-2-ylidene)oxazolidine-2,4-diShow More⌵

Mol. Formula:
C14H13ClFNO4

M.W.:
313.71

Type:
Small molecule

AlogP:
3.65

Polar Surface Area:
55.84

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA2269484

Name:
3-(4-chloro-2-fluoro-5-(hexyloxy)phenyl)-5-(propan-2-ylidene)oxazolidine-2,Show More⌵

Mol. Formula:
C18H21ClFNO4

M.W.:
369.82