Type:
---AlogP:
0.23Polar Surface Area:
77.24HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.70DETAILS
ALA5221106Name:
4-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxamideMol. Formula:
C9H11N3OM.W.:
177.21Type:
---AlogP:
0.46Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.65DETAILS
Type:
---AlogP:
0.89Polar Surface Area:
65.21HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.75DETAILS
ALA5220990Name:
(S)-2-propyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxamideMol. Formula:
C11H15N3OM.W.:
205.26Type:
---AlogP:
1.32Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.78DETAILS
ALA5220955Name:
(R)-4-chloro-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxamideMol. Formula:
C9H10ClN3OM.W.:
211.65Type:
---AlogP:
1.19Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.73DETAILS-
Type:
---AlogP:
0.92Polar Surface Area:
45.75HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.60DETAILS -
Type:
---AlogP:
-0.38Polar Surface Area:
80.90HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.60DETAILS - ALA5220889
Name:
(R)-2,4-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxamideMol. Formula:
C10H13N3OM.W.:
191.23Type:
---AlogP:
0.85Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
---AlogP:
0.84Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.71DETAILS - 4-Chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
Name:
4-chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxamideMol. Formula:
C8H6ClN3OM.W.:
195.61Type:
---AlogP:
1.32Polar Surface Area:
71.77HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA5220590
Name:
(R)-2-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxamideMol. Formula:
C9H11N3OM.W.:
177.21Type:
---AlogP:
0.54Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA5220577
Name:
(S)-2-Methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxamideMol. Formula:
C9H11N3OM.W.:
177.21Type:
---AlogP:
0.54Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
---AlogP:
0.80Polar Surface Area:
64.94HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA5220340
Name:
5-carbamoyl-4-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-7-oxideMol. Formula:
C9H11N3O2M.W.:
193.21Type:
---AlogP:
-0.30Polar Surface Area:
82.06HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA5220313
Name:
4-methyl-6-(methylamino)pyridine-3-carbothioamideMol. Formula:
C8H11N3SM.W.:
181.26Type:
---AlogP:
1.07Polar Surface Area:
50.94HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.67DETAILS - ALA5220292
Name:
5,6,7,8-tetrahydro-1,8-naphthyridine-3-carboxamideMol. Formula:
C9H11N3OM.W.:
177.21Type:
---AlogP:
0.54Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA5220274
Name:
(2S,3R)-2,3-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxamideMol. Formula:
C10H13N3OM.W.:
191.23Type:
---AlogP:
1.10Polar Surface Area:
68.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
---AlogP:
0.06Polar Surface Area:
84.66HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.62DETAILS - ALA5220247
Name:
1-methyl-5-oxo-5,6-dihydro-1,6-naphthyridin-1-iumMol. Formula:
C9H9N2O+M.W.:
161.18Type:
---AlogP:
0.35Polar Surface Area:
36.74HBA:
1HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.56DETAILS - ALA5220203
Name:
1-methyl-5-oxo-5,6,7,8-tetrahydro-1,6-naphthyridin-1-iumMol. Formula:
C9H11N2O+M.W.:
163.20Type:
---AlogP:
-0.20Polar Surface Area:
32.98HBA:
1HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.53DETAILS
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