Cephalexin Monohydrate

Name: Cephalexin Monohydrate
SKU: PI23325782
Rating: 5 (1 reviews)

Cat. No.: PI23325782

Product Details Other Identifiers Computed Properties

CAS	23325-78-2
Synonyms	(6R,7R)-7-((R)-2-Amino-2-phenylacetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrate
Purity	98%
Molecular Formula	C16H19N3O5S
Molecular Weight	365.40
Molar Refractivity	95.1

Pubchem ID	62921
InChI Key	AVGYWQBCYZHHPN-CYJZLJNKSA-N
MDL Number	MFCD00167148

Hydrogen Bond Donor Count	4.0
Hydrogen Bond Acceptor Count	6.0
Rotatable Bond Count	5
Topological Polar Surface Area	147.26 Å²
Heavy Atom Count	25
Aromatic Heavy Atoms Number	6
Fraction Csp3	0.31
Log Po/w (iLOGP)	1.81
Log Po/w (XLOGP3)	0.18
Log Po/w (WLOGP)	-0.32
Log Po/w (MLOGP)	-0.12
Log Po/w (SILICOS-IT)	0.14
Consensus Log Po/w	0.34
GI Absorption	Low
BBB Permeant	No
P-gp Substrate	Yes
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-8.4 cm/s
Lipinski	0.0
Ghose	None
Veber	1.0
Egan	1.0
Muegge	0.0
Bioavailability Score	0.55
PAINS	0.0 alert
Brenk	0.0 alert
Leadlikeness	1.0
Synthetic Accessibility	4.51

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