Compounds

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2111749

Name:
2-[3-(2-amino-3-hydroxy-4-methyl-pentanoylamino)-p
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Mol. Formula:
C44H77N5O11Si2

M.W.:
908.30

28 activity values

13 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2111748

Name:
2-[3-(2-Benzyloxycarbonylamino-3-hydroxy-4-methyl-
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Mol. Formula:
C52H83N5O13Si2

M.W.:
1042.43

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA194623

Name:
3-(3,5-Difluoro-phenyl)-N-[2-(2,6-dimethyl-phenyld
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Mol. Formula:
C19H20F2N2O2S2

M.W.:
410.51

2 activity values

1 unique targets

Type:
Small molecule

AlogP:
4.51

Polar Surface Area:
61.69

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA325278

Name:
(2S,3R)-2-[3-((R)-2-Amino-4-methyl-pentanoylamino)
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Mol. Formula:
C32H49N5O10

M.W.:
663.77

Type:
Small molecule

AlogP:
-0.77

Polar Surface Area:
216.60

HBA:
14

HBD:
6

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.10

DETAILS

ALA114703

Name:
(2S,3R)-2-[3-((R)-2-Benzyloxycarbonylamino-4-methy
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Mol. Formula:
C36H47N5O12

M.W.:
741.79

Type:
Small molecule

AlogP:
-0.06

Polar Surface Area:
239.91

HBA:
14

HBD:
7

#RO5 Violations:
3

#Rotatable Bonds:
18

Passes Ro3:
N

QED Weighted:
0.08

DETAILS

ALA116005

Name:
(2S,3R)-2-[3-((R)-2-Amino-4-methyl-pentanoylamino)
Show More⌵

Mol. Formula:
C28H41N5O10

M.W.:
607.66

Type:
Small molecule

AlogP:
-2.03

Polar Surface Area:
227.60

HBA:
13

HBD:
7

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.11

DETAILS

ALA113984

Name:
(2S,3R)-2-[3-((R)-2-Benzyloxycarbonylamino-3-hydro
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Mol. Formula:
C40H67N5O12Si2

M.W.:
866.17

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA325306

Name:
(2S,3R)-2-[3-((R)-2-Amino-4-phenyl-butyrylamino)-p
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Mol. Formula:
C48H77N5O10Si2

M.W.:
940.34

8 activity values

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA415374

Name:
2-[3-(2-Benzyloxycarbonylamino-4-phenyl-butyrylami
Show More⌵

Mol. Formula:
C56H83N5O12Si2

M.W.:
1074.47

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA413428

Name:
Muraymycin analogue

Mol. Formula:
C63H103N11O16Si2

M.W.:
1326.75

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA114707

Name:
Muraymycin analogue

Mol. Formula:
C40H62N10O14

M.W.:
906.99

8 activity values

Type:
Small molecule

AlogP:
-3.04

Polar Surface Area:
373.51

HBA:
16

HBD:
12

#RO5 Violations:
3

#Rotatable Bonds:
25

Passes Ro3:
N

QED Weighted:
0.03

DETAILS

ALA384252

Name:
2-[3-(2-Benzyloxycarbonylamino-3-hydroxy-butyrylam
Show More⌵

Mol. Formula:
C50H79N5O13Si2

M.W.:
1014.38

11 activity values

5 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA322940

Name:
(2S,3R)-2-[3-((R)-2-Amino-4-methyl-pentanoylamino)
Show More⌵

Mol. Formula:
C44H77N5O10Si2

M.W.:
892.30

8 activity values

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA325014

Name:
(2S,3R)-2-[3-((R)-2-Benzyloxycarbonylamino-4-methy
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Mol. Formula:
C40H55N5O12

M.W.:
797.90

Type:
Small molecule

AlogP:
1.19

Polar Surface Area:
228.91

HBA:
15

HBD:
6

#RO5 Violations:
3

#Rotatable Bonds:
18

Passes Ro3:
N

QED Weighted:
0.08

DETAILS

ALA114140

Name:
(2S,3R)-2-[3-((R)-2-Amino-3-hydroxy-butyrylamino)-
Show More⌵

Mol. Formula:
C42H73N5O11Si2

M.W.:
880.24

16 activity values

6 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA214711

Name:
2-[3-(2-Amino-3-hydroxy-4-methyl-pentanoylamino)-p
Show More⌵

Mol. Formula:
C47H67N11O16

M.W.:
1042.11

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA436779

Name:
Muraymycin analogue

Mol. Formula:
C61H99N11O17Si2

M.W.:
1314.69

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA426348

Name:
Muraymycin analogue

Mol. Formula:
C63H103N11O17Si2

M.W.:
1342.75

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA263684

Name:
Muraymycin analogue

Mol. Formula:
C56H98N10O14Si2

M.W.:
1191.63