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ALA4090675 Name:
(E)-2-ethyl-3-(4-(3-(4-isopropylpiperazin-1-yl)pro
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Mol. Formula:
C25H33N5
M.W.:
403.57
Type:
Small molecule
AlogP:
4.08
Polar Surface Area:
37.19
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA4088230 Name:
(E)-N-(4-(3-(4-isopropylpiperazin-1-yl)prop-1-en-1
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Mol. Formula:
C28H43N5
M.W.:
449.69
Type:
Small molecule
AlogP:
5.19
Polar Surface Area:
35.50
HBA:
5
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4080377 Name:
5-(dimethylamino)-N-(4-(((2,6-dimethylpyrimidin-4-
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Mol. Formula:
C25H39N5O
M.W.:
425.62
Type:
Small molecule
AlogP:
4.82
Polar Surface Area:
61.36
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4095465 Name:
(E)-2-isobutyl-3-(4-(3-(4-isopropylpiperazin-1-yl)
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Mol. Formula:
C29H41N5
M.W.:
459.68
Type:
Small molecule
AlogP:
5.33
Polar Surface Area:
37.19
HBA:
5
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4072373 Name:
(E)-2-isopropyl-3-(4-(3-(4-isopropylpiperazin-1-yl
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Mol. Formula:
C28H39N5
M.W.:
445.66
Type:
Small molecule
AlogP:
5.26
Polar Surface Area:
37.19
HBA:
5
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4069664 Name:
(E)-6-ethyl-7-(4-(3-(4-isopropylpiperazin-1-yl)pro
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Mol. Formula:
C27H37N5
M.W.:
431.63
Type:
Small molecule
AlogP:
4.70
Polar Surface Area:
37.19
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4063894 Name:
(E)-3-(4-(3-(4-isopropylpiperazin-1-yl)prop-1-en-1
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Mol. Formula:
C28H39N5
M.W.:
445.66
Type:
Small molecule
AlogP:
5.09
Polar Surface Area:
37.19
HBA:
5
HBD:
---
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA4060989 Name:
(E)-3-(4-(3-(4-isopropylpiperazin-1-yl)prop-1-en-1
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Mol. Formula:
C26H35N5
M.W.:
417.60
Type:
Small molecule
AlogP:
4.44
Polar Surface Area:
37.19
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
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