Compounds

ALA2287691

Name:
ethyl 4-methyl-6-(prop-2-ynylamino)-1,3,5-triazine
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Mol. Formula:
C10H12N4O2

M.W.:
220.23

4 activity values

2 unique targets

Type:
Small molecule

AlogP:
0.40

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA2287690

Name:
ethyl 4-(allylamino)-6-methyl-1,3,5-triazine-2-car
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Mol. Formula:
C10H14N4O2

M.W.:
222.25

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
0.95

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA2287689

Name:
ethyl 4-(isopropylamino)-6-methyl-1,3,5-triazine-2
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Mol. Formula:
C10H16N4O2

M.W.:
224.26

4 activity values

2 unique targets

Type:
Small molecule

AlogP:
1.18

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA2287688

Name:
ethyl 4-methyl-6-(propylamino)-1,3,5-triazine-2-ca
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Mol. Formula:
C10H16N4O2

M.W.:
224.26

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
1.18

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.76

DETAILS

ALA2287687

Name:
ethyl 4-(ethylamino)-6-methyl-1,3,5-triazine-2-car
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Mol. Formula:
C9H14N4O2

M.W.:
210.24

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
0.79

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA2287686

Name:
N-ethyl-4-(ethylamino)-6-methyl-1,3,5-triazine-2-c
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Mol. Formula:
C9H15N5O

M.W.:
209.25

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
0.36

Polar Surface Area:
79.80

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA2287685

Name:
N,4-dimethyl-6-(methylamino)-1,3,5-triazine-2-carb
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Mol. Formula:
C7H11N5O

M.W.:
181.20

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
-0.42

Polar Surface Area:
79.80

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA2287684

Name:
ethyl 4-(benzylamino)-6-methyl-1,3,5-triazine-2-ca
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Mol. Formula:
C14H16N4O2

M.W.:
272.31

4 activity values

2 unique targets

Type:
Small molecule

AlogP:
1.97

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.84

DETAILS

ALA2287683

Name:
methyl 4-(benzylamino)-6-methyl-1,3,5-triazine-2-c
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Mol. Formula:
C13H14N4O2

M.W.:
258.28

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
1.58

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.84

DETAILS

ALA2287682

Name:
ethyl 4-(sec-butylamino)-6-methyl-1,3,5-triazine-2
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Mol. Formula:
C11H18N4O2

M.W.:
238.29

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
1.57

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA2287681

Name:
ethyl 4-(butylamino)-6-methyl-1,3,5-triazine-2-car
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Mol. Formula:
C11H18N4O2

M.W.:
238.29

3 activity values

2 unique targets

Type:
Small molecule

AlogP:
1.57

Polar Surface Area:
77.00

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.60

DETAILS