ALA3884338Name:
5-Hydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acidMol. Formula:
C15H8O5M.W.:
268.22Type:
Small moleculeAlogP:
1.87Polar Surface Area:
91.67HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.70DETAILS
ALA3884123Name:
4-Hydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acidMol. Formula:
C15H8O5M.W.:
268.22Type:
Small moleculeAlogP:
1.87Polar Surface Area:
91.67HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.70DETAILS
Type:
Small moleculeAlogP:
13.78Polar Surface Area:
95.50HBA:
3HBD:
3#RO5 Violations:
2#Rotatable Bonds:
35Passes Ro3:
NQED Weighted:
0.06DETAILS
ALA94849Name:
2,4-Bis(octadecanoylamino)benzenesulfonic acid sodium salt derivativeMol. Formula:
C35H69N2NaO6SM.W.:
669.00Type:
Small moleculeAlogP:
9.37Polar Surface Area:
121.80HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
34Passes Ro3:
NQED Weighted:
0.05DETAILS
ALA96575Name:
Sodium salt 4-octadecanoylamino-benzenesulfonateMol. Formula:
C24H40NNaO4SM.W.:
461.64Type:
Small moleculeAlogP:
7.13Polar Surface Area:
83.47HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
18Passes Ro3:
NQED Weighted:
0.19DETAILS- ALA96329
Name:
Sodium salt 2,4-bis-docosanoylamino-benzenesulfonateMol. Formula:
C50H91N2NaO5SM.W.:
855.34Type:
Small moleculeAlogP:
16.45Polar Surface Area:
112.57HBA:
4HBD:
3#RO5 Violations:
2#Rotatable Bonds:
43Passes Ro3:
NQED Weighted:
0.04DETAILS - ALA328876
Name:
2,4-Bis(octadecanoylamino)benzenesulfonic acid sodium salt derivativeMol. Formula:
C42H75N2NaO6SM.W.:
759.13Type:
Small moleculeAlogP:
13.02Polar Surface Area:
121.80HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
36Passes Ro3:
NQED Weighted:
0.05DETAILS - ALA328665
Name:
2,4-Bis(octadecanoylamino)benzenesulfonic acid sodium salt derivativeMol. Formula:
C42H75N2NaO6SM.W.:
759.13Type:
Small moleculeAlogP:
13.02Polar Surface Area:
121.80HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
36Passes Ro3:
NQED Weighted:
0.05DETAILS - ALA96749
Name:
Sodium salt 4-decanoylamino-2-tetradecanoylamino-benzenesulfonateMol. Formula:
C26H43N2NaO5SM.W.:
518.70Type:
Small moleculeAlogP:
7.09Polar Surface Area:
112.57HBA:
4HBD:
3#RO5 Violations:
1#Rotatable Bonds:
19Passes Ro3:
NQED Weighted:
0.14DETAILS - ALA96863
Name:
Sodium salt 2,4-bis-tetradecanoylamino-benzenesulfonateMol. Formula:
C34H59N2NaO5SM.W.:
630.91Type:
Small moleculeAlogP:
10.21Polar Surface Area:
112.57HBA:
4HBD:
3#RO5 Violations:
2#Rotatable Bonds:
27Passes Ro3:
NQED Weighted:
0.07DETAILS - ALA316476
Name:
2,4-Bis(octadecanoylamino)benzenesulfonic acid sodium salt derivativeMol. Formula:
C42H75N2NaO6SM.W.:
759.13Type:
Small moleculeAlogP:
13.02Polar Surface Area:
121.80HBA:
5HBD:
3#RO5 Violations:
2#Rotatable Bonds:
36Passes Ro3:
NQED Weighted:
0.05DETAILS - ALA96802
Name:
2,4-Bis(octadecanoylamino)benzenesulfonic acid sodium salt derivativeMol. Formula:
C37H71N2NaO6SM.W.:
695.04Type:
Small moleculeAlogP:
9.85Polar Surface Area:
113.01HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
32Passes Ro3:
NQED Weighted:
0.05DETAILS - ALA262658
Name:
Sodium salt 3,5-bis-octadecanoylamino-benzenesulfonateMol. Formula:
C42H75N2NaO5SM.W.:
743.13Type:
Small moleculeAlogP:
13.33Polar Surface Area:
112.57HBA:
4HBD:
3#RO5 Violations:
2#Rotatable Bonds:
35Passes Ro3:
NQED Weighted:
0.05DETAILS - ALA95043
Name:
Sodium salt 2,4-bis-octadecanoylamino-benzenesulfonateMol. Formula:
C42H75N2NaO5SM.W.:
743.13Type:
Small moleculeAlogP:
13.33Polar Surface Area:
112.57HBA:
4HBD:
3#RO5 Violations:
2#Rotatable Bonds:
35Passes Ro3:
NQED Weighted:
0.05DETAILS - ALA265796
Name:
Sodium salt 2,5-bis-octadecanoylamino-benzenesulfonateMol. Formula:
C42H75N2NaO5SM.W.:
743.13Type:
Small moleculeAlogP:
13.33Polar Surface Area:
112.57HBA:
4HBD:
3#RO5 Violations:
2#Rotatable Bonds:
35Passes Ro3:
NQED Weighted:
0.05DETAILS
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