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CAS 537-09-7 EVERNIC ACID molecular structure lightbox
CAS RN: 537-09-7

EVERNIC ACID

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2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251101 10mg In stock Shanghai Inquiry
Batchno.20250210 10mg Out of stock Inquiry
  • Product code: starshine_CAS537-09-7
  • Purity/Analytical Methods: >99.0%
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537-09-7 / 2-hydroxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-6-methylbenzoic acid

Standard CAS: 537-09-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
537-09-7
Multi CAS
Yes
Molecular Formula
C17H16O7
Molecular Weight
332.300000
Exact Mass
332.089603
InChI
InChI=1S/C17H16O7/c1-8-5-11(7-12(18)14(8)16(20)21)24-17(22)15-9(2)4-10(23-3)6-13(15)19/h4-7,18-19H,1-3H3,(H,20,21)
InChIKey
GODLCSLPZIBRMG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.18
Rotatable bonds
4
H-bond acceptors
6
H-bond donors
3
Molar refractivity
84.16
TPSA
113.29

LogP / Solubility

WLOGP
2.64
MLOGP
2.34
XLogP3
4
Consensus LogP
2.99
Log S (ESOL)
-3.67
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.19
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.49
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.87

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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