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CAS 18110-86-6 5-Hydroxy-4-methoxy-6H-indolo[3,2,1-de][1,5]naphthyridin-6-one molecular structure lightbox
CAS RN: 18110-86-6

5-Hydroxy-4-methoxy-6H-indolo[3,2,1-de][1,5]naphthyridin-6-one

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5 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260112 5mg Out of stock 30 business days Inquiry
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Batchno.20260202 10mg In stock Shanghai Inquiry
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Batchno.20251008 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS18110-86-6
  • Purity/Analytical Methods: >99.0%
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18110-86-6 / 3-hydroxy-4-methoxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one

Standard CAS: 18110-86-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
18110-86-6
Multi CAS
No
Molecular Formula
C15H10N2O3
Molecular Weight
266.250000
Exact Mass
266.069142
SMILES
COC1=C(C(=O)N2C3=CC=CC=C3C4=C2C1=NC=C4)O
InChI
InChI=1S/C15H10N2O3/c1-20-14-11-12-9(6-7-16-11)8-4-2-3-5-10(8)17(12)15(19)13(14)18/h2-7,18H,1H3
InChIKey
PGFKZUOYIFDMQJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
16
Fraction Csp3
0.07
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
75.88
TPSA
63.83

LogP / Solubility

WLOGP
2.15
MLOGP
1.9
XLogP3
2
Consensus LogP
2.02
Log S (ESOL)
-3.37
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.3
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.3
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.82

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2

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