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ALA5208735 Name:
(2S)-2-[[8-(cyclohexoxy)-2-(3-fluoro-4-methoxy-phenyl)-1-oxo-pyrido[2,1-b][Show More⌵
Mol. Formula:
C34H31FN2O7S
M.W.:
630.69
Type:
---
AlogP:
6.17
Polar Surface Area:
126.57
HBA:
8
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA5203417 Name:
N2-(2-(trifluoromethoxy)phenyl)-N4-(4-(trifluoromethoxy)phenyl)pyrimidine-2Show More⌵
Mol. Formula:
C18H12F6N4O2
M.W.:
430.31
Type:
---
AlogP:
5.76
Polar Surface Area:
68.30
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA5197404 Name:
N2-(3-(trifluoromethoxy)phenyl)-N4-(4-(trifluoromethoxy)phenyl)pyrimidine-2Show More⌵
Mol. Formula:
C18H12F6N4O2
M.W.:
430.31
Type:
---
AlogP:
5.76
Polar Surface Area:
68.30
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.48
DETAILS
CLOSE
ALA5194803 Name:
N2-(3-(trifluoromethoxy)phenyl)-N4-(4-(trifluoromethyl)phenyl)pyrimidine-2,Show More⌵
Mol. Formula:
C18H12F6N4O
M.W.:
414.31
Type:
---
AlogP:
5.88
Polar Surface Area:
59.07
HBA:
5
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA5189366 Name:
N4-benzyl-N2-(2-(trifluoromethoxy)phenyl)pyrimidine-2,4-diamine
Mol. Formula:
C18H15F3N4O
M.W.:
360.34
Type:
---
AlogP:
4.73
Polar Surface Area:
59.07
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA5186175 Name:
N4-(2-methyl-4-(trifluoromethoxy)phenyl)-N2-(2-(trifluoromethoxy)phenyl)pyrShow More⌵
Mol. Formula:
C19H14F6N4O2
M.W.:
444.34
Type:
---
AlogP:
6.07
Polar Surface Area:
68.30
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA5170015 Name:
N4-(2-methyl-4-(trifluoromethoxy)phenyl)-N2-(3-(trifluoromethoxy)phenyl)pyrShow More⌵
Mol. Formula:
C19H14F6N4O2
M.W.:
444.34
Type:
---
AlogP:
6.07
Polar Surface Area:
68.30
HBA:
6
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA4649364 Name:
5'-chloro-1-[(4-methylsulfonylphenyl)methyl]spiro[5,7-dihydropyrazolo[3,4-bShow More⌵
Mol. Formula:
C21H17ClN4O4S
M.W.:
456.91
Type:
Unknown
AlogP:
2.57
Polar Surface Area:
110.16
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4648032 Name:
4-[(5'-chloro-2',6-dioxo-spiro[5,7-dihydropyrazolo[3,4-b]pyridine-4,3'-indoShow More⌵
Mol. Formula:
C21H15ClN4O4
M.W.:
422.83
Type:
Unknown
AlogP:
2.86
Polar Surface Area:
113.32
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA4646275 Name:
1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5'-chloro-spiro[5,7-dihydropyrazShow More⌵
Mol. Formula:
C22H13ClF6N4O2
M.W.:
514.81
Type:
Unknown
AlogP:
5.20
Polar Surface Area:
76.02
HBA:
4
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA4645424 Name:
5'-chloro-1-[(4-chloro-2-fluoro-phenyl)methyl]spiro[5,7-dihydropyrazolo[3,4Show More⌵
Mol. Formula:
C20H13Cl2FN4O2
M.W.:
431.25
Type:
Unknown
AlogP:
3.96
Polar Surface Area:
76.02
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4645097 Name:
5'-chloro-1-[(4-chlorophenyl)methyl]-2',6-dioxo-spiro[5,7-dihydropyrrolo[2,Show More⌵
Mol. Formula:
C22H14Cl2N4O2
M.W.:
437.29
Type:
Unknown
AlogP:
4.30
Polar Surface Area:
86.92
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4643269 Name:
5'-chloro-2-[(3,4-dichlorophenyl)methyl]spiro[5,7-dihydropyrazolo[3,4-b]pyrShow More⌵
Mol. Formula:
C20H13Cl3N4O2
M.W.:
447.71
Type:
Unknown
AlogP:
4.47
Polar Surface Area:
76.02
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4642971 Name:
5-acetyl-5'-chloro-1-[(4-chlorophenyl)methyl]spiro[5,7-dihydropyrazolo[3,4-Show More⌵
Mol. Formula:
C22H16Cl2N4O3
M.W.:
455.30
Type:
Unknown
AlogP:
3.63
Polar Surface Area:
93.09
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4642472 Name:
5'-chloro-1-[(4-chlorophenyl)methyl]-2',6-dioxo-spiro[5,7-dihydropyrazolo[3Show More⌵
Mol. Formula:
C21H13Cl2N5O2
M.W.:
438.27
Type:
Unknown
AlogP:
3.57
Polar Surface Area:
99.81
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.64
DETAILS
CLOSE
ALA4640773 Name:
4-[(5'-chloro-2',6-dioxo-spiro[5,7-dihydropyrazolo[3,4-b]pyridine-4,3'-indoShow More⌵
Mol. Formula:
C21H14ClN5O2
M.W.:
403.83
Type:
Unknown
AlogP:
3.04
Polar Surface Area:
99.81
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.69
DETAILS
CLOSE
ALA4639442 Name:
methyl 4-[(5'-chloro-2',6-dioxo-spiro[5,7-dihydropyrazolo[3,4-b]pyridine-4,Show More⌵
Mol. Formula:
C22H17ClN4O4
M.W.:
436.86
Type:
Unknown
AlogP:
2.95
Polar Surface Area:
102.32
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4639227 Name:
5'-chloro-1-[(3,4-dichlorophenyl)methyl]spiro[5,7-dihydropyrazolo[3,4-b]pyrShow More⌵
Mol. Formula:
C20H13Cl3N4O2
M.W.:
447.71
Type:
Unknown
AlogP:
4.47
Polar Surface Area:
76.02
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4638806 Name:
5'-chloro-1-[(4-chloro-3-fluoro-phenyl)methyl]spiro[5,7-dihydropyrazolo[3,4Show More⌵
Mol. Formula:
C20H13Cl2FN4O2
M.W.:
431.25
Type:
Unknown
AlogP:
3.96
Polar Surface Area:
76.02
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4637828 Name:
5'-chloro-1-[(4-fluorophenyl)methyl]spiro[5,7-dihydropyrazolo[3,4-b]pyridinShow More⌵
Mol. Formula:
C20H14ClFN4O2
M.W.:
396.81
Type:
Unknown
AlogP:
3.30
Polar Surface Area:
76.02
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
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