Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
ALA4633638Name:
1-[2,4-dihydroxy-3-(1H-indol-3-ylmethyl)-5-methyl-phenyl]ethanoneMol. Formula:
C18H17NO3M.W.:
295.34Type:
UnknownAlogP:
3.68Polar Surface Area:
73.32HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.65DETAILS
ALA4569515Name:
N-(2-(2-hydroxybenzamido)ethyl)-3beta-hydroxy-urs-12-en-28-amideMol. Formula:
C39H58N2O4M.W.:
618.90Type:
UnknownAlogP:
7.26Polar Surface Area:
98.66HBA:
4HBD:
4#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.21DETAILS
ALA4464620Name:
N-(2-(2-hydroxybenzamido)ethyl)-3beta-hydroxy-olean-12-en-28-amideMol. Formula:
C39H58N2O4M.W.:
618.90Type:
UnknownAlogP:
7.40Polar Surface Area:
98.66HBA:
4HBD:
4#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.20DETAILS
Type:
Small moleculeAlogP:
2.63Polar Surface Area:
185.65HBA:
9HBD:
7#RO5 Violations:
2#Rotatable Bonds:
24Passes Ro3:
NQED Weighted:
0.06DETAILS- ALA1934619
Name:
N-Acrylamido-3,5-dideoxy-D-glycero-D-galacto-2-nonulosaminic acidMol. Formula:
C12H19NO9M.W.:
321.28Type:
Small moleculeAlogP:
-3.71Polar Surface Area:
176.78HBA:
8HBD:
7#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.24DETAILS -
Type:
Small moleculeAlogP:
1.96Polar Surface Area:
156.55HBA:
8HBD:
6#RO5 Violations:
2#Rotatable Bonds:
18Passes Ro3:
NQED Weighted:
0.12DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
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