Compounds

ALA4790822

Name:
(2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More⌵

Mol. Formula:
C38H38ClFN6O6S

M.W.:
761.28

13 activity values

3 unique targets

Type:
Unknown

AlogP:
6.73

Polar Surface Area:
128.21

HBA:
12

HBD:
1

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.13

DETAILS

ALA4762804

Name:
(2R)-2-[[(5Sa)-5-[3-chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More⌵

Mol. Formula:
C47H45ClFN7O5S

M.W.:
874.44

6 activity values

3 unique targets

Type:
Unknown

AlogP:
8.90

Polar Surface Area:
135.06

HBA:
12

HBD:
2

#RO5 Violations:
3

#Rotatable Bonds:
16

Passes Ro3:
N

QED Weighted:
0.10

DETAILS

ALA4758300

Name:
(2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More⌵

Mol. Formula:
C40H38ClFN6O5S

M.W.:
769.30

12 activity values

3 unique targets

Type:
Unknown

AlogP:
7.20

Polar Surface Area:
123.03

HBA:
11

HBD:
1

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.12

DETAILS

ALA4757943

Name:
(2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More⌵

Mol. Formula:
C46H43ClFN7O5S

M.W.:
860.41

6 activity values

3 unique targets

Type:
Unknown

AlogP:
8.57

Polar Surface Area:
135.92

HBA:
12

HBD:
1

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.11

DETAILS

ALA4757520

Name:
(2R)-2-([(5Sa)-5-(3-Chloro-4-[2-(dimethylamino)ethoxy]-2-methylphenyl)-6-(4Show More⌵

Mol. Formula:
C44H39ClFN5O6S

M.W.:
820.34

6 activity values

3 unique targets

Type:
Unknown

AlogP:
9.19

Polar Surface Area:
129.02

HBA:
11

HBD:
1

#RO5 Violations:
3

#Rotatable Bonds:
16

Passes Ro3:
N

QED Weighted:
0.10

DETAILS

ALA4754629

Name:
(2R)-2-[[(5Sa)-5-[3-chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More⌵

Mol. Formula:
C44H44ClN7O5S

M.W.:
818.40

6 activity values

3 unique targets

Type:
Unknown

AlogP:
7.47

Polar Surface Area:
135.06

HBA:
12

HBD:
2

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.10

DETAILS

ALA4753960

Name:
(2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More⌵

Mol. Formula:
C42H43ClFN7O7S

M.W.:
844.37

6 activity values

3 unique targets

Type:
Unknown

AlogP:
6.63

Polar Surface Area:
148.64

HBA:
14

HBD:
1

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.12

DETAILS

ALA4743512

Name:
(2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More⌵

Mol. Formula:
C40H42ClFN6O6S

M.W.:
789.33

6 activity values

3 unique targets

Type:
Unknown

AlogP:
7.78

Polar Surface Area:
128.21

HBA:
12

HBD:
1

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.11

DETAILS

ALA4741562

Name:
(2R)-2-([(5Sa)-5-(3-Chloro-2-methyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]pheShow More⌵

Mol. Formula:
C44H45ClFN7O6S

M.W.:
854.40

6 activity values

3 unique targets

Type:
Unknown

AlogP:
7.03

Polar Surface Area:
135.50

HBA:
13

HBD:
1

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.11

DETAILS