ALA5206136Name:
N-(adamantan-1-yl)-6-chloro-4-oxo-1,4-dihydroquinoline-3-carboxamideMol. Formula:
C20H21ClN2O2M.W.:
356.85Type:
---AlogP:
3.88Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS
ALA5201756Name:
N-(adamantan-1-yl)-5,8-dichloro-4-oxo-1,4-dihydroquinoline-3-carboxamideMol. Formula:
C20H20Cl2N2O2M.W.:
391.30Type:
---AlogP:
4.53Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS
ALA5201154Name:
N-(adamantan-1-yl)-5,8-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxamideMol. Formula:
C20H20Cl2N2O2M.W.:
391.30Type:
---AlogP:
4.53Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS
Type:
---AlogP:
5.40Polar Surface Area:
73.99HBA:
2HBD:
3#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.50DETAILS
ALA5199446Name:
2-(1-Adamantyl)-N-(1H-benzimidazol-2-yl)acetamideMol. Formula:
C19H23N3OM.W.:
309.41Type:
---AlogP:
4.11Polar Surface Area:
57.78HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.90DETAILS- ALA5198199
Name:
N-(adamantan-1-yl)-6-chloro-4-oxo-1,4-dihydroquinoline-2-carboxamideMol. Formula:
C20H21ClN2O2M.W.:
356.85Type:
---AlogP:
3.88Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA5197962
Name:
4,6-Difluoro-N-(3-methylbenzyl)-1H-indole-2-carboxamideMol. Formula:
C17H14F2N2OM.W.:
300.31Type:
---AlogP:
3.68Polar Surface Area:
44.89HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA5195348
Name:
N-(1H-Benzimidazol-2-yl)-4,6-difluoro-1H-indole-2-carboxamideMol. Formula:
C16H10F2N4OM.W.:
312.28Type:
---AlogP:
3.57Polar Surface Area:
73.57HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA5195215
Name:
4,6-Difluoro-N-(4-fluorobenzyl)-1H-indole-2-carboxamideMol. Formula:
C16H11F3N2OM.W.:
304.27Type:
---AlogP:
3.52Polar Surface Area:
44.89HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
---AlogP:
3.95Polar Surface Area:
56.41HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA5194106
Name:
N-(adamantan-1-yl)-7,8-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxamideMol. Formula:
C20H20Cl2N2O2M.W.:
391.30Type:
---AlogP:
4.53Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
---AlogP:
5.33Polar Surface Area:
73.99HBA:
2HBD:
3#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.48DETAILS - ALA5192764
Name:
N-(adamantan-1-yl)-7,8-dichloro-4-oxo-1,4-dihydroquinoline-3-carboxamideMol. Formula:
C20H20Cl2N2O2M.W.:
391.30Type:
---AlogP:
4.53Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA5192005
Name:
N-(adamantan-1-yl)-5,7-dichloro-4-oxo-1,4-dihydroquinoline-3-carboxamideMol. Formula:
C20H20Cl2N2O2M.W.:
391.30Type:
---AlogP:
4.53Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA5191451
Name:
N-(Homopiperonyl)-4,6-difluoro-1H-indole-2-carboxamideMol. Formula:
C18H14F2N2O3M.W.:
344.32Type:
---AlogP:
3.15Polar Surface Area:
63.35HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA5189652
Name:
N-(adamantan-1-yl)-7-bromo-4-oxo-1,4-dihydroquinoline-2-carboxamideMol. Formula:
C20H21BrN2O2M.W.:
401.30Type:
---AlogP:
3.99Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA5186924
Name:
N-(adamantan-1-yl)-7-bromo-4-oxo-1,4-dihydroquinoline-3-carboxamideMol. Formula:
C20H21BrN2O2M.W.:
401.30Type:
---AlogP:
3.99Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.80DETAILS -
Type:
---AlogP:
3.26Polar Surface Area:
73.99HBA:
2HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA5180227
Name:
N-(adamantan-1-yl)-5,7-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxamideMol. Formula:
C20H20Cl2N2O2M.W.:
391.30Type:
---AlogP:
4.53Polar Surface Area:
61.96HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
---AlogP:
3.38Polar Surface Area:
44.89HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.76DETAILS
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