Compounds

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ALA355031
Name:
2-Amino-4-[1-(carboxymethyl-carbamoyl)-2-(3-nitro-
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Mol. Formula:
C18H22N4O10S
M.W.:
486.46

2 activity values

1 unique targets
Type:
Small molecule
AlogP:
-0.16
Polar Surface Area:
228.26
HBA:
10
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.14
DETAILS
CLOSE
ALA169316
Name:
2-Amino-4-[2-benzyloxycarbonylsulfanyl-1-(carboxym
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Mol. Formula:
C18H23N3O8S
M.W.:
441.46

2 activity values

1 unique targets
Type:
Small molecule
AlogP:
-0.07
Polar Surface Area:
185.12
HBA:
8
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA353372
Name:
2-Amino-4-[1-(carboxymethyl-carbamoyl)-2-(2-nitro-
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Mol. Formula:
C18H22N4O10S
M.W.:
486.46

2 activity values

1 unique targets
Type:
Small molecule
AlogP:
-0.16
Polar Surface Area:
228.26
HBA:
10
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.14
DETAILS
CLOSE
ALA168630
Name:
2-Amino-4-[1-(carboxymethyl-carbamoyl)-2-(4-nitro-
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Mol. Formula:
C18H22N4O10S
M.W.:
486.46

3 activity values

2 unique targets
Type:
Small molecule
AlogP:
-0.16
Polar Surface Area:
228.26
HBA:
10
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.14
DETAILS
CLOSE
ALA50249
Name:
(S)-2-Amino-4-[(R)-2-benzyloxycarbonylsulfanyl-1-(
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Mol. Formula:
C18H23N3O8S
M.W.:
441.46

6 activity values

4 unique targets
Type:
Small molecule
AlogP:
-0.07
Polar Surface Area:
185.12
HBA:
8
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
12
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE