Compounds

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ALA3350647
Name:
alpha,beta-methylene AzddTPP
Mol. Formula:
C12H20N5O13P3
M.W.:
535.24
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
0.87
Polar Surface Area:
267.22
HBA:
10
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA3350644
Name:
beta,gama-methylene AzddTPP
Mol. Formula:
C12H20N5O13P3
M.W.:
535.24
2 activity values
2 unique targets
Type:
Small molecule
AlogP:
0.66
Polar Surface Area:
267.22
HBA:
10
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.08
DETAILS
CLOSE
ALA97981
Name:
But-2-enedioic acid bis-({5-[5-(3-cyano-propylcarbamoyl)-1-methyl-1H-pyrrolShow More⌵
Mol. Formula:
C36H40N12O6
M.W.:
736.79
2 activity values
1 unique targets
Type:
Small molecule
AlogP:
2.75
Polar Surface Area:
241.90
HBA:
12
HBD:
6
#RO5 Violations:
3
#Rotatable Bonds:
16
Passes Ro3:
N
QED Weighted:
0.07
DETAILS
CLOSE
ALA409809
Name:
Bis(2N-[5-(3-amino-3-imminopropylcarbamoyl)-1-methyl-1H-3-pyrrolyl]-1-methyShow More⌵
Mol. Formula:
C50H58Cl2N18O8
M.W.:
1110.04
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA427592
Name:
Bis(2N-[5-(3-amino-3-imminopropylcarbamoyl)-1-methyl-1H-3-pyrrolyl]-1-methyShow More⌵
Mol. Formula:
C51H62Cl2N18O8
M.W.:
1126.08
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE
ALA384119
Name:
Tri(2N-[5-(3-amino-3-imminopropylcarbamoyl)-1-methyl-1H-3-pyrrolyl]-1-methyShow More⌵
Mol. Formula:
C72H84Cl3N27O12
M.W.:
1626.00
3 activity values
2 unique targets
Type:
Small molecule
AlogP:
---
Polar Surface Area:
---
HBA:
---
HBD:
---
#RO5 Violations:
na
#Rotatable Bonds:
---
Passes Ro3:
---
QED Weighted:
---
DETAILS
CLOSE