Compounds

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ALA5283465
Name:
[3-(dimethylamino)propyl-hydroxy-phosphoryl]methyl
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Mol. Formula:
C6H17NO5P2
M.W.:
245.15

Type:
---
AlogP:
0.34
Polar Surface Area:
98.07
HBA:
3
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
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ALA5280439
Name:
[2-guanidinoethyl(hydroxy)phosphoryl]methylphospho
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Mol. Formula:
C4H13N3O5P2
M.W.:
245.11

Type:
---
AlogP:
-1.12
Polar Surface Area:
156.73
HBA:
3
HBD:
6
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
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ALA5288410
Name:
4-(dimethylamino)-N-methylsulfonyl-butanamide

Mol. Formula:
C7H16N2O3S
M.W.:
208.28

Type:
---
AlogP:
-0.60
Polar Surface Area:
66.48
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
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ALA5265751
Name:
3-guanidino-N-methylsulfonyl-propanamide

Mol. Formula:
C5H12N4O3S
M.W.:
208.24

Type:
---
AlogP:
-2.06
Polar Surface Area:
125.14
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
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ALA1189029
Name:
3-guanidinopropanehydroxamic acid

Mol. Formula:
C4H10N4O2
M.W.:
146.15

1 activity values

1 unique targets
Type:
Small molecule
AlogP:
-1.64
Polar Surface Area:
111.23
HBA:
3
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.14
DETAILS
CLOSE