- ALA3753280
Name:
(2Z,4E)-2-(5-methoxy-1H-indol-3-yl)-5-(pyridin-3-yl)penta-2,4-dienenitrileMol. Formula:
C19H15N3OM.W.:
301.35Type:
Small moleculeAlogP:
4.19Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA3752665
Name:
(E)-3-(5-methoxy-1H-indol-3-yl)-4-(pyridin-3-yl)-but-2-enenitrileMol. Formula:
C18H15N3OM.W.:
289.34Type:
Small moleculeAlogP:
3.72Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA3754437
Name:
(E)-2-(5-methoxy-1H-indol-3-carbonyl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C18H13N3O2M.W.:
303.32Type:
Small moleculeAlogP:
3.36Polar Surface Area:
78.77HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.46DETAILS - ALA3752091
Name:
2-(5-methoxy-1H-indol-3-yl)-2-(pyridin-3-yl)acetonitrileMol. Formula:
C16H13N3OM.W.:
263.30Type:
Small moleculeAlogP:
3.23Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.79DETAILS Type:
Small moleculeAlogP:
3.41Polar Surface Area:
52.47HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS- ALA3753648
Name:
(Z)-3-(1H-indol-3-yl)-2-pyridin-3-yl-acrylonitrileMol. Formula:
C16H11N3M.W.:
245.28Type:
Small moleculeAlogP:
3.63Polar Surface Area:
52.47HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA3751920
Name:
(Z)-2-(1-acetyl-5-methoxy-1H-indol-3-yl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C19H15N3O2M.W.:
317.35Type:
Small moleculeAlogP:
3.77Polar Surface Area:
67.91HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA3754251
Name:
(Z)-2-(5-methoxy-1-methyl-1H-indol-3-yl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C18H15N3OM.W.:
289.34Type:
Small moleculeAlogP:
3.65Polar Surface Area:
50.84HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA3753423
Name:
(Z)-3-(pyridin-3-yl)-2-[2-(thiophen-3-yl)-1H-indol-3-yl]-acrylonitrileMol. Formula:
C20H13N3SM.W.:
327.41Type:
Small moleculeAlogP:
5.36Polar Surface Area:
52.47HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA3752493
Name:
(Z)-2-(2-phenyl-1H-indol-3-yl)-3-(pyridin-3-yl)-acrylonitrileMol. Formula:
C22H15N3M.W.:
321.38Type:
Small moleculeAlogP:
5.29Polar Surface Area:
52.47HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA3752183
Name:
(Z)-2-(5-methoxy-2-methyl-1H-indol-3-yl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C18H15N3OM.W.:
289.34Type:
Small moleculeAlogP:
3.94Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA3753668
Name:
(Z)-3-(pyridin-3-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)-acrylonitrileMol. Formula:
C15H10N4M.W.:
246.27Type:
Small moleculeAlogP:
3.02Polar Surface Area:
65.36HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA3751934
Name:
(Z)-2-(7-methoxy-1H-indol-3-yl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C17H13N3OM.W.:
275.31Type:
Small moleculeAlogP:
3.64Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA3753782
Name:
(Z)-2-(4-methoxy-1H-indol-3-yl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C17H13N3OM.W.:
275.31Type:
Small moleculeAlogP:
3.64Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA3753970
Name:
(Z)-2-(6-methoxy-1H-indol-3-yl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C17H13N3OM.W.:
275.31Type:
Small moleculeAlogP:
3.64Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA3753380
Name:
(Z)-2-(5-benzyloxy-1H-indol-3-yl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C23H17N3OM.W.:
351.41Type:
Small moleculeAlogP:
5.21Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA3754608
Name:
(Z)-2-(5-methoxy-1H-indol-3-yl)-3-pyridin-3-yl-acrylonitrileMol. Formula:
C17H13N3OM.W.:
275.31Type:
Small moleculeAlogP:
3.64Polar Surface Area:
61.70HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA3752442
Name:
(Z)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(1H-indol-3-yl)-acrylonitrileMol. Formula:
C19H16N2O3M.W.:
320.35Type:
Small moleculeAlogP:
3.95Polar Surface Area:
78.27HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA3753464
Name:
(Z)-2-(1H-indol-3-yl)-3-(3,4,5-trimethoxyphenyl)-acrylonitrileMol. Formula:
C20H18N2O3M.W.:
334.38Type:
Small moleculeAlogP:
4.26Polar Surface Area:
67.27HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA3753378
Name:
(Z)-2-(1H-indol-3-yl)-3-(2,4,6-trimethoxyphenyl)-acrylonitrileMol. Formula:
C20H18N2O3M.W.:
334.38Type:
Small moleculeAlogP:
4.26Polar Surface Area:
67.27HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS