Salicylanilide

Name: Salicylanilide
SKU: PI87172
Rating: 5 (1 reviews)

Cat. No.: PI87172

Product Details Other Identifiers Computed Properties

CAS	87-17-2
Synonyms	2-Hydroxy-N-phenylbenzamide
Purity	95%
Molecular Formula	C13H11NO2
Linear Formula	C6H5NHC(O)C6H4OH
Molecular Weight	213.23
Molar Refractivity	62.68

Pubchem ID	6872
InChI Key	WKEDVNSFRWHDNR-UHFFFAOYSA-N
MDL Number	MFCD00002212

Hydrogen Bond Donor Count	2.0
Hydrogen Bond Acceptor Count	2.0
Rotatable Bond Count	3
Topological Polar Surface Area	49.33 Å²
Heavy Atom Count	16
Aromatic Heavy Atoms Number	12
Fraction Csp3	0.0
Log Po/w (iLOGP)	1.75
Log Po/w (XLOGP3)	3.27
Log Po/w (WLOGP)	2.45
Log Po/w (MLOGP)	2.4
Log Po/w (SILICOS-IT)	2.11
Consensus Log Po/w	2.4
GI Absorption	High
BBB Permeant	Yes
P-gp Substrate	No
CYP1A2Inhibitor	Yes
CYP2C19Inhibitor	No
CYP2C9Inhibitor	Yes
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-5.28 cm/s
Lipinski	0.0
Ghose	None
Veber	0.0
Egan	0.0
Muegge	0.0
Bioavailability Score	0.55
PAINS	0.0 alert
Brenk	0.0 alert
Leadlikeness	1.0
Synthetic Accessibility	1.18

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