CAS RN: 93957-55-2

Fluvastatin Sodium Salt

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12 package records12 with current stock3 grade groups
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  • Product code: ICTF0820
  • Purity/Analytical Methods: >98.0%(HPLC)(N)
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93957-55-2 / sodium (E)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoate

Standard CAS: 93957-55-2 Multi CAS: Yes

Basic Information

CAS
93957-55-2
Multi CAS
Yes
Molecular Formula
C24H25FNNAO4
Molecular Weight
433.400000
Exact Mass
433.166531
InChI
InChI=1S/C24H26FNO4.Na/c1-15(2)26-21-6-4-3-5-20(21)24(16-7-9-17(25)10-8-16)22(26)12-11-18(27)13-19(28)14-23(29)30;/h3-12,15,18-19,27-28H,13-14H2,1-2H3,(H,29,30);/q;+1/p-1/b12-11+;
InChIKey
ZGGHKIMDNBDHJB-CALJPSDSSA-M

Computed Properties

Structural Parameters

Heavy atom count
31
Aromatic heavy atom count
15
Fraction Csp3
0.29
Rotatable bonds
8
H-bond acceptors
5
H-bond donors
2
Molar refractivity
113.01
TPSA
85.52

LogP / Solubility

WLOGP
0.3
MLOGP
0.29
XLogP3
0.3
Consensus LogP
0.3
Log S (ESOL)
-2.54
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.33
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.68
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.15

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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