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CAS 14674-67-0 DEUTERIUM OXIDE-18O molecular structure lightbox
CAS RN: 14674-67-0

DEUTERIUM OXIDE-18O

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260306 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS14674-67-0
  • Purity/Analytical Methods: >99.0%
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14674-67-0 / DEUTERIUM OXIDE-18O

Standard CAS: 14674-67-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14674-67-0
Multi CAS
No
Molecular Formula
H2O
Molecular Weight
22.027363
Exact Mass
22.027363
SMILES
[2H][18O][2H]
InChI
InChI=1S/H2O/h1H2/i1+2/hD2
InChIKey
XLYOFNOQVPJJNP-LAPWFLRPSA-N

Computed Properties

Structural Parameters

Heavy atom count
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
3.61
TPSA
31.5

LogP / Solubility

WLOGP
-0.82
MLOGP
-0.75
XLogP3
-0.5
Consensus LogP
-0.69
Log S (ESOL)
0.57
Class (ESOL)
Highly soluble
Log S (Ali)
0.89
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.91
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.42

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1

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