Compounds

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268760

Name:
2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)-5
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Mol. Formula:
C16H23F2N3OSi

M.W.:
339.46

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268759

Name:
2-Phenyl-1-(1H-1,2,4-triazol-1-yl)-5-trimethylsily
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Mol. Formula:
C16H25N3OSi

M.W.:
303.48

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268758

Name:
2-(4-Chlorophenyl)-1-(1H-1,2,4-triazol-1-yl)-5-tri
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Mol. Formula:
C16H24ClN3OSi

M.W.:
337.93

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268757

Name:
2-(4-Fluorophenyl)-1-(1H-1,2,4-triazol-1-yl)-5-tri
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Mol. Formula:
C16H24FN3OSi

M.W.:
321.47

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268756

Name:
2-(2,4-Dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)-4
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Mol. Formula:
C15H21Cl2N3OSi

M.W.:
358.34

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268755

Name:
2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)-4
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Mol. Formula:
C15H21F2N3OSi

M.W.:
325.43

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268754

Name:
2-(4-Methoxyphenyl)-1-(1H-1,2,4-triazol-1-yl)-4-tr
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Mol. Formula:
C16H25N3O2Si

M.W.:
319.48

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268753

Name:
2-(4-Methylphenyl)-1-(1H-1,2,4-triazol-1-yl)-4-tri
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Mol. Formula:
C16H25N3OSi

M.W.:
303.48

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268752

Name:
2-Phenyl-1-(1H-1,2,4-triazol-1-yl)-4-trimethylsily
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Mol. Formula:
C15H23N3OSi

M.W.:
289.45

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268751

Name:
2-(4-Bromophenyl)-1-(1H-1,2,4-triazol-1-yl)-4-trim
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Mol. Formula:
C15H22BrN3OSi

M.W.:
368.35

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2268750

Name:
2-(4-Chlorophenyl)-1-(1H-1,2,4-triazol-1-yl)-4-tri
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Mol. Formula:
C15H22ClN3OSi

M.W.:
323.90

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2229596

Name:
[(1R,2S,8R,9S,10S,12R,13S,14S,17S,19R,20S,21R)-5-[
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Cas Number:
943136-39-8

Mol. Formula:
C38H44O11

M.W.:
676.76

37 activity values

20 unique targets

Type:
Small molecule

AlogP:
3.08

Polar Surface Area:
162.73

HBA:
11

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA2228801

Name:
wilfoside C1N

Mol. Formula:
C56H90O19

M.W.:
1067.32

3 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2228800

Name:
wilfoside C1G

Mol. Formula:
C62H100O24

M.W.:
1229.46

3 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2228799

Name:
wilfoside C1GG

Mol. Formula:
C68H110O29

M.W.:
1391.60

2 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2228798

Name:
wilfoside K1N

Mol. Formula:
C58H86O19

M.W.:
1087.31

1 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2228797

Name:
wilfoside K1GG

Mol. Formula:
C70H106O29

M.W.:
1411.59

1 activity values