CAS RN: 97575-49-0

6-Methylgenistein

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260512 5mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS97575-49-0
  • Purity/Analytical Methods: >99.0%
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97575-49-0 / 5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methylchromen-4-one

Standard CAS: 97575-49-0 Multi CAS: Yes

Basic Information

CAS
97575-49-0
Multi CAS
Yes
Molecular Formula
C16H12O5
Molecular Weight
284.260000
Exact Mass
284.068473
InChI
InChI=1S/C16H12O5/c1-8-12(18)6-13-14(15(8)19)16(20)11(7-21-13)9-2-4-10(17)5-3-9/h2-7,17-19H,1H3
InChIKey
DPFIBLHIYGLZEN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
16
Fraction Csp3
0.06
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
3
Molar refractivity
77.65
TPSA
90.9

LogP / Solubility

WLOGP
2.89
MLOGP
2.55
XLogP3
3
Consensus LogP
2.81
Log S (ESOL)
-3.92
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.97
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.02
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)
-2.41

Drug-likeness / Medicinal Chemistry

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

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