Compounds

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4564746

Name:
(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-5-[[N-[4-[6-[3,Show More⌵

Mol. Formula:
C81H113F9N16O16

M.W.:
1737.87

8 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4537266

Name:
4-[2-[5-[1-[6-[2-[2-[2-[[N-[(4S)-4-amino-5-[[(1S)-1-[(2S)-2-[[(1S)-2-[[(1S,Show More⌵

Mol. Formula:
C84H122F6N16O22S2

M.W.:
1886.11

8 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4534768

Name:
(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-5-[[N-[2-[2-[2-Show More⌵

Mol. Formula:
C85H118F12N16O20

M.W.:
1911.95

8 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4463399

Name:
(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-5-[[N-[2-[2-[2-Show More⌵

Mol. Formula:
C72H101F12N15O19

M.W.:
1708.66

9 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4457798

Name:
4-[2-[5-[1-[6-[4-[[N-[(4S)-4-amino-5-[[(1S)-1-[(2S)-2-[[(1S)-2-[[(1S,2S)-1-Show More⌵

Mol. Formula:
C82H118F6N16O20S2

M.W.:
1826.06

9 activity values

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4100456

Name:
H-Lys-Lys-Pro-Lys-Ile-TMSAla-OH

Mol. Formula:
C35H69N9O7Si

M.W.:
756.08

5 activity values

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4084378

Name:
H-Lys-Lys-Pro-Lys-Ile-Leu-OH

Mol. Formula:
C35H67N9O7

M.W.:
725.98

5 activity values

Type:
Small molecule

AlogP:
-0.19

Polar Surface Area:
278.09

HBA:
10

HBD:
9

#RO5 Violations:
2

#Rotatable Bonds:
26

Passes Ro3:
N

QED Weighted:
0.05

DETAILS

ALA4082440

Name:
H-Lys-Lys-Pro-Glu-Ile-Leu-OH

Mol. Formula:
C34H62N8O9

M.W.:
726.92

4 activity values

Type:
Small molecule

AlogP:
-0.46

Polar Surface Area:
289.37

HBA:
10

HBD:
9

#RO5 Violations:
2

#Rotatable Bonds:
25

Passes Ro3:
N

QED Weighted:
0.05

DETAILS

ALA4076517

Name:
H-Lys-Lys-Pro-His-Ile-Leu-OH

Mol. Formula:
C35H62N10O7

M.W.:
734.94

3 activity values

Type:
Small molecule

AlogP:
-0.36

Polar Surface Area:
280.75

HBA:
10

HBD:
9

#RO5 Violations:
2

#Rotatable Bonds:
24

Passes Ro3:
N

QED Weighted:
0.06

DETAILS

ALA4074624

Name:
H-Lys-Lys-Pro-Asp-Ile-Leu-OH

Mol. Formula:
C33H60N8O9

M.W.:
712.89

4 activity values

Type:
Small molecule

AlogP:
-0.85

Polar Surface Area:
289.37

HBA:
10

HBD:
9

#RO5 Violations:
2

#Rotatable Bonds:
24

Passes Ro3:
N

QED Weighted:
0.06

DETAILS

ALA3979668

Name:
(S)-2-((2S,3S)-2-((S)-2-((S)-1-((S)-6-amino-2-((S)-2,6-diaminohexanamido)heShow More⌵

Mol. Formula:
C38H63BrN8O7

M.W.:
823.88

Type:
Protein

AlogP:
1.68

Polar Surface Area:
252.07

HBA:
9

HBD:
8

#RO5 Violations:
2

#Rotatable Bonds:
24

Passes Ro3:
N

QED Weighted:
0.07

DETAILS

ALA3971946

Name:
(S)-2-(2-((2S,3R)-3-((S)-1-((S)-2-((S)-2-amino-5-guanidinopentanamido)-5-guShow More⌵

Mol. Formula:
C36H58N12O9

M.W.:
802.94

3 activity values

Type:
Small molecule

AlogP:
-2.23

Polar Surface Area:
353.29

HBA:
11

HBD:
13

#RO5 Violations:
3

#Rotatable Bonds:
21

Passes Ro3:
N

QED Weighted:
0.04

DETAILS

ALA3959801

Name:
(S)-2-((2S,3S)-2-((2R,3S)-3-((S)-1-((S)-2-((S)-2-amino-5-guanidinopentanamiShow More⌵

Mol. Formula:
C40H66N12O9

M.W.:
859.04

Type:
Small molecule

AlogP:
-0.82

Polar Surface Area:
353.29

HBA:
11

HBD:
13

#RO5 Violations:
3

#Rotatable Bonds:
23

Passes Ro3:
N

QED Weighted:
0.04

DETAILS

ALA3954824

Name:
(2S)-2-(3-((S)-1-((S)-2-((S)-2-amino-5-guanidinopentanamido)-5-guanidinopenShow More⌵

Mol. Formula:
C34H54BrN11O7

M.W.:
808.78

4 activity values

Type:
Small molecule

AlogP:
-0.29

Polar Surface Area:
303.96

HBA:
9

HBD:
11

#RO5 Violations:
2

#Rotatable Bonds:
19

Passes Ro3:
N

QED Weighted:
0.05

DETAILS

ALA3951982

Name:
(S)-2-((2S,3S)-2-((2R,3S)-2-(4-bromophenyl)-3-((S)-1-((S)-2-((S)-2,6-diaminShow More⌵

Mol. Formula:
C40H65BrN10O8

M.W.:
893.93

Type:
Small molecule

AlogP:
1.11

Polar Surface Area:
297.18

HBA:
10

HBD:
10

#RO5 Violations:
2

#Rotatable Bonds:
23

Passes Ro3:
N

QED Weighted:
0.04

DETAILS

ALA3950695

Name:
(S)-2-((2S,3S)-2-((R)-2-((S)-1-((S)-6-amino-2-((S)-2,6-diaminohexanamido)heShow More⌵

Mol. Formula:
C38H63BrN8O7

M.W.:
823.88