Compounds

ALA2414996

Name:
4-Methylpyrano[2,3-b]carbazol-2(10H)-one

Mol. Formula:
C16H11NO2

M.W.:
249.27

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.74

Polar Surface Area:
46.00

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA2414995

Name:
3,11-Dihydro-3-oxopyrano[3,2-a]carbazole-2-carboxy
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Mol. Formula:
C16H9NO4

M.W.:
279.25

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.13

Polar Surface Area:
83.30

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA2414994

Name:
Ethyl 3,11-dihydro-3-oxopyrano[3,2-a]carbazole-2-c
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Mol. Formula:
C18H13NO4

M.W.:
307.31

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.60

Polar Surface Area:
72.30

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA2414993

Name:
Pyrano[3,2-a]carbazol-3(11H)-one

Mol. Formula:
C15H9NO2

M.W.:
235.24

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.43

Polar Surface Area:
46.00

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
---

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA2068568

Name:
Ethyl (R/S)-2,3-Diaminopropionate{7,12-bis[1-(1,4,
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Mol. Formula:
C53H74N6O14Pt

M.W.:
1214.28

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068567

Name:
Ethyl (R/S)-2,3-Diaminopropionate{7,12-bis[1-(poly
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Mol. Formula:
C110H188N6O42Pt

M.W.:
2461.79

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068565

Name:
Diethyl meso-4,5-Diaminosuberate{7,12-bis[1-(1,4,7
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Mol. Formula:
C56H78N6O14Pt

M.W.:
1254.35

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068562

Name:
Ethyl (S)-2,4-Diaminobutanoate{7,12-bis[1-(poly(et
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Mol. Formula:
C110H188N6O42Pt

M.W.:
2461.79

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068552

Name:
Diethyl meso-4,5-Diaminosuberate{7,12-bis[1-(1,4,7
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Mol. Formula:
C60H86N6O16Pt

M.W.:
1342.45

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068548

Name:
Diammine[2-(4-{10,15,20-tris[4-(poly(ethyleneglyco
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Mol. Formula:
C152H244N6O59Pt

M.W.:
3294.69

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068546

Name:
Ethyl (S)-2,4-Diaminobutanoate{7,12-bis[1-(1,4,7,1
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Mol. Formula:
C54H76N6O14Pt

M.W.:
1228.31

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068544

Name:
Ethyl (S)-2,4-Diaminobutanoate{7,12-bis[1-(1,4,7-t
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Mol. Formula:
C50H68N6O12Pt

M.W.:
1140.20

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068543

Name:
Ethyl (S)-2,4-Diaminobutanoate{7,12-bis[1-(1,4,7,1
Show More⌵

Mol. Formula:
C62H92N6O18Pt

M.W.:
1404.52

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068542

Name:
Ethyl (R/S)-2,3-Diaminopropionate{7,12-bis[1-(1,4,
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Mol. Formula:
C61H90N6O18Pt

M.W.:
1390.49

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068541

Name:
Ethyl (R/S)-2,3-Diaminopropionate{7,12-bis[1-(1,4,
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Mol. Formula:
C57H82N6O16Pt

M.W.:
1302.39

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068540

Name:
Diammine[2-(4-{10,15,20-tris[4-(1,4,7,10-tetraoxau
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Mol. Formula:
C68H76N6O17Pt

M.W.:
1444.46

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068525

Name:
(RR/SS)-trans-1,2-Diaminocyclohexane[2-(4-{10,15,2
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Mol. Formula:
C158H252N6O59Pt

M.W.:
3374.82

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068519

Name:
Diethyl meso-4,5-Diaminosuberate{7,12-bis[1-(1,4,7
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Mol. Formula:
C68H102N6O20Pt

M.W.:
1518.66

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068412

Name:
Diethyl meso-4,5-Diaminosuberate{7,12-bis[1-(1,4,7
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Mol. Formula:
C64H94N6O18Pt

M.W.:
1430.56

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA2068411

Name:
Ethyl (S)-2,4-Diaminobutanoate{7,12-bis[1-(1,4,7,1
Show More⌵

Mol. Formula:
C58H84N6O16Pt

M.W.:
1316.41

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS