Compounds

ALA3084911

Name:
1-[5-Hydroxymethyl-4-(2,8,9-trioxa-5-aza-1-sila-bicyclo[3.3.3]undec-1-yloxyShow More⌵

Mol. Formula:
C16H25N3O8Si

M.W.:
415.48

5 activity values

4 unique targets

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2374228

Name:
1-[5-Hydroxymethyl-4-(3,7,10-trimethyl-2,8,9-trioxa-5-aza-1-sila-bicyclo[3.Show More⌵

Mol. Formula:
C19H31N3O8Si

M.W.:
457.56

5 activity values

5 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2374227

Name:
1-[5-Hydroxymethyl-4-((3R,7R,10R)-3,7,10-trimethyl-2,8,9-trioxa-5-aza-1-silShow More⌵

Mol. Formula:
C19H31N3O8Si

M.W.:
457.56

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA419965

Name:
1-[4-(17-Acetyl-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-teShow More⌵

Mol. Formula:
C36H44N2O3S

M.W.:
584.83

15 activity values

3 unique targets

Type:
Small molecule

AlogP:
8.38

Polar Surface Area:
75.27

HBA:
4

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA129251

Name:
4-(14-acetyl-2,15-dimethyl-5-oxotetracyclo[8.7.0.02,7.011,15]heptadec-6-en-Show More⌵

Mol. Formula:
C35H42N2O5S2

M.W.:
634.86

15 activity values

3 unique targets

Type:
Small molecule

AlogP:
7.31

Polar Surface Area:
109.41

HBA:
6

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA338904

Name:
1-[4-(17-Acetyl-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-teShow More⌵

Mol. Formula:
C30H40N2O3S

M.W.:
508.73

15 activity values

3 unique targets

Type:
Small molecule

AlogP:
6.64

Polar Surface Area:
75.27

HBA:
4

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA131172

Name:
1-[4-(17-Acetyl-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-teShow More⌵

Mol. Formula:
C30H39ClN2O3S

M.W.:
543.17

15 activity values

3 unique targets

Type:
Small molecule

AlogP:
6.85

Polar Surface Area:
75.27

HBA:
4

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA306791

Name:
A-007 analogue

Mol. Formula:
C35H32ClN7O6S

M.W.:
714.20

10 activity values

6 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA306887

Name:
A-007 analogue

Mol. Formula:
C34H30ClN7O6S

M.W.:
700.18

4 activity values

4 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA71739

Name:
A-007 analogue

Mol. Formula:
C31H24ClN7O6S

M.W.:
658.10

4 activity values

4 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS