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CAS 623574-00-5 Zabofloxacin molecular structure lightbox
CAS RN: 623574-00-5

Zabofloxacin

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250822 5mg / 10mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS623574-00-5
  • Purity/Analytical Methods: >99.0%
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623574-00-5 / 1-cyclopropyl-6-fluoro-7-[(8Z)-8-methoxyimino-2,6-diazaspiro[3.4]octan-6-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid;hydrochloride

Standard CAS: 623574-00-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
623574-00-5
Multi CAS
Yes
Molecular Formula
C19H21CLFN5O4
Molecular Weight
437.900000
Exact Mass
437.126610
InChI
InChI=1S/C19H20FN5O4.ClH/c1-29-23-14-6-24(9-19(14)7-21-8-19)17-13(20)4-11-15(26)12(18(27)28)5-25(10-2-3-10)16(11)22-17;/h4-5,10,21H,2-3,6-9H2,1H3,(H,27,28);1H/b23-14+;
InChIKey
IFPBSRFVNPCZMK-MHVDTSALSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
10
Fraction Csp3
0.47
Rotatable bonds
4
H-bond acceptors
8
H-bond donors
2
Molar refractivity
110.4
TPSA
109.05

LogP / Solubility

WLOGP
1.4
MLOGP
1.26
XLogP3
1.4
Consensus LogP
1.35
Log S (ESOL)
-3.42
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.15
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.4

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5

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