Compounds

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3985283

Name:
N-[6-[[[[[4,7,10-Tris(carboxymethyl)-1,4,7,10-tetr
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Mol. Formula:
C72H101N19O18S

M.W.:
1552.78

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3984587

Name:
2,2',2''-(10-((5S,8S,11S,17S,20S,23S,26S,29S)-11-(
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Mol. Formula:
C78H113N19O20S

M.W.:
1668.94

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3984268

Name:
N-[(3beta,5beta,7alpha,12alpha)-3-[[[[[[4,7,10-Tri
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Mol. Formula:
C89H141N19O22S

M.W.:
1861.29

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3984233

Name:
2-[4-[2-[[2-[4-[[(1S)-4-amino-1-[[(1S)-2-[[(1S)-2-
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Mol. Formula:
C72H99N19O18

M.W.:
1518.70

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3983862

Name:
2,2',2''-(10-(2-(((1r,4r)-4-(((1S,4r)-4-((5S,8S,11
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Mol. Formula:
C75H117N19O18S

M.W.:
1604.94

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3982939

Name:
(2S)-2-[[2-[[2-[[(2R)-3-(acetamidomethylsulfanyl)-
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Mol. Formula:
C60H93N19O16S2

M.W.:
1400.65

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3982672

Name:
2-[4-[2-[[(1S)-2-[[(1S)-2-[[(1S)-4-amino-1-[[(1S)-
Show More⌵

Mol. Formula:
C81H117N19O18S

M.W.:
1677.01

Type:
Protein

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3981343

Name:
2,2',2''-(10-(2-(((1r,4r)-4-((5S,8S,11S,17S,20S,23
Show More⌵

Mol. Formula:
C73H115N19O20S

M.W.:
1610.90

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3980591

Name:
N-[2-S-[[[[[12alpha-Hydroxy-17alpha-(1-methyl-3-ca
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Mol. Formula:
C106H171N25O27S

M.W.:
2259.75

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3980433

Name:
2,2',2''-(10-(2-(2-(4-((5S,8S,11S,17S,20S,23S,26S)
Show More⌵

Mol. Formula:
C67H106N20O17S

M.W.:
1495.78

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3979188

Name:
2-[4-[2-[[8-[[(1S)-4-amino-1-[[(1S)-2-[[(1S)-2-[[(
Show More⌵

Mol. Formula:
C67H106N18O17S

M.W.:
1467.76

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3978969

Name:
2,2',2''-(10-(2-(((1S,4r)-4-((5S,8S,11S,17S,20S,23
Show More⌵

Mol. Formula:
C80H115N19O18S

M.W.:
1662.98

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3978343

Name:
N-[(3beta,5beta,12alpha)-3-[[[4,7,10-Tris(carboxym
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Mol. Formula:
C77H108N20O19S

M.W.:
1649.90

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3978275

Name:
(3S)-3-[[2-[2-[2-[[2-[[(2R)-3-(acetamidomethylsulf
Show More⌵

Mol. Formula:
C68H106N20O21S2

M.W.:
1603.85

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3978233

Name:
N-[(3beta,5beta)-3-[[[[[4,7,10-Tris(carboxymethyl)
Show More⌵

Mol. Formula:
C85H131N19O19S

M.W.:
1755.16

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3978062

Name:
2,2',2''-(10-(2-((R)-1-((5S,8S,11S,17S,20S,23S,26S
Show More⌵

Mol. Formula:
C67H103N19O18S

M.W.:
1494.74

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3975769

Name:
(S)-N1-((5S,8S,11S,17S,20S,23S)-11-((1H-imidazol-5
Show More⌵

Mol. Formula:
C70H113N23O19S2

M.W.:
1644.95

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3975022

Name:
N-[[3beta,5beta,12alpha)-3-[[[4,7,10-Tris[carboxym
Show More⌵

Mol. Formula:
C69H98N20O17S

M.W.:
1511.73