ALA4250153Name:
2,5-Bis[6-(N,N-dimethylamidino)indol-2-yl]pyrazineMol. Formula:
C26H26N8M.W.:
450.55Type:
Small moleculeAlogP:
4.55Polar Surface Area:
111.54HBA:
4HBD:
4#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.24DETAILS
ALA4249813Name:
1,4-Bis{6-[(pyrrolidin-1-yl)(imino)methyl]indol-2-yl}benzeneMol. Formula:
C32H32N6M.W.:
500.65Type:
Small moleculeAlogP:
6.83Polar Surface Area:
85.76HBA:
2HBD:
4#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.16DETAILS
ALA4249695Name:
2,5-Bis[6-(N,N-dimethylamidino)indol-2-yl]pyridineMol. Formula:
C27H27N7M.W.:
449.56Type:
Small moleculeAlogP:
5.15Polar Surface Area:
98.65HBA:
3HBD:
4#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.23DETAILS
ALA4249635Name:
1,4-Bis{6-[N-(3-pentyl)-amidino]indol-2-yl}benzeneMol. Formula:
C34H40N6M.W.:
532.74Type:
Small moleculeAlogP:
8.19Polar Surface Area:
103.34HBA:
2HBD:
6#RO5 Violations:
3#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.08DETAILS
ALA4249349Name:
1,4-Bis{6-[(1,4-oxazine-4-yl)(imino)methyl]indol-2-yl}benzeneMol. Formula:
C32H32N6O2M.W.:
532.65Type:
Small moleculeAlogP:
5.30Polar Surface Area:
104.22HBA:
4HBD:
4#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.19DETAILS- ALA4248560
Name:
1,4-Bis{6-[(trimethyleneimino-1-yl)(imino)methyl]indol-2-yl}benzeneMol. Formula:
C30H28N6M.W.:
472.60Type:
Small moleculeAlogP:
6.05Polar Surface Area:
85.76HBA:
2HBD:
4#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.19DETAILS - ALA4246526
Name:
1,4-Bis[6-(N-(3-N,N-dimethylaminopropyl)-amidino)indol-2-yl]benzeneMol. Formula:
C34H42N8M.W.:
562.77Type:
Small moleculeAlogP:
5.72Polar Surface Area:
109.82HBA:
4HBD:
6#RO5 Violations:
3#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.07DETAILS -
Type:
Small moleculeAlogP:
4.47Polar Surface Area:
116.23HBA:
3HBD:
6#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.19DETAILS -
Type:
Small moleculeAlogP:
7.47Polar Surface Area:
92.24HBA:
4HBD:
4#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.12DETAILS - ALA4245899
Name:
2,5-Bis[6-(N,N-dimethylamidino)indol-2-yl]thiazoleMol. Formula:
C25H25N7SM.W.:
455.59Type:
Small moleculeAlogP:
5.21Polar Surface Area:
98.65HBA:
4HBD:
4#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.22DETAILS - ALA4245546
Name:
1,4-Bis{6-[(2,5-dihydro-1H-pyrrol-1-yl)(imino)methyl]indol-2-yl}benzeneMol. Formula:
C32H28N6M.W.:
496.62Type:
Small moleculeAlogP:
6.38Polar Surface Area:
85.76HBA:
2HBD:
4#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.13DETAILS - ALA4245072
Name:
3,5-Bis[6-(N-isopropylamidino)indol-2-yl]pyridineMol. Formula:
C29H31N7M.W.:
477.62Type:
Small moleculeAlogP:
6.02Polar Surface Area:
116.23HBA:
3HBD:
6#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.13DETAILS - ALA4244329
Name:
1,4-Bis[6-(N-methyl-N-ethylamidino)indol-2-yl]benzeneMol. Formula:
C30H32N6M.W.:
476.63Type:
Small moleculeAlogP:
6.54Polar Surface Area:
85.76HBA:
2HBD:
4#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.17DETAILS -
Type:
Small moleculeAlogP:
5.85Polar Surface Area:
103.34HBA:
2HBD:
6#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.14DETAILS - ALA4242094
Name:
2,7-Bis[6-(N,N-dimethylamidino)indol-2-yl]naphthaleneMol. Formula:
C32H30N6M.W.:
498.63Type:
Small moleculeAlogP:
6.91Polar Surface Area:
85.76HBA:
2HBD:
4#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.16DETAILS -
Type:
Small moleculeAlogP:
5.76Polar Surface Area:
85.76HBA:
2HBD:
4#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.21DETAILS -
Type:
Small moleculeAlogP:
5.07Polar Surface Area:
103.34HBA:
2HBD:
6#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.18DETAILS -
Type:
Small moleculeAlogP:
7.41Polar Surface Area:
103.34HBA:
2HBD:
6#RO5 Violations:
3#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.10DETAILS - ALA4239593
Name:
2,6-Bis[6-(N,N-dimethylamidino)indol-2-yl]naphthaleneMol. Formula:
C32H30N6M.W.:
498.63Type:
Small moleculeAlogP:
6.91Polar Surface Area:
85.76HBA:
2HBD:
4#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.16DETAILS - ALA4239274
Name:
1,4-Bis{6-[(3,6-dihydro-2H-pyridine-1-yl)(imino)methyl]indol-2-yl}benzeneMol. Formula:
C34H32N6M.W.:
524.67Type:
Small moleculeAlogP:
7.16Polar Surface Area:
85.76HBA:
2HBD:
4#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.11DETAILS
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