1-(6-Fluoro-1H-indol-3-yl)-N,N-dimethylmethanamine

Name: 1-(6-Fluoro-1H-indol-3-yl)-N,N-dimethylmethanamine
SKU: PI343931
Rating: 5 (1 reviews)

Cat. No.: PI343931

Product Details Other Identifiers Computed Properties

CAS	343-93-1
Purity	98%
Molecular Formula	C11H13FN2
Molecular Weight	192.23
Molar Refractivity	55.73

Pubchem ID	2774471
InChI Key	PAAOUYLDLVHKKR-UHFFFAOYSA-N
MDL Number	MFCD00056918

Aromatic Heavy Atoms Number	9
BBB Permeant	Yes
Bioavailability Score	0.55
Brenk	0.0 alert
Consensus Log Po/w	2.4
CYP1A2Inhibitor	Yes
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Egan	0.0
Fraction Csp3	0.27
Ghose	None
GI Absorption	High
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2.0
Hydrogen Bond Donor Count	1.0
Leadlikeness	1.0
Lipinski	0.0
Log Kp (Skin Permeation)	-5.78 cm/s
Log Po/w (iLOGP)	2.17
Log Po/w (MLOGP)	1.96
Log Po/w (SILICOS-IT)	2.82
Log Po/w (WLOGP)	2.64
Log Po/w (XLOGP3)	2.39
Muegge	1.0
PAINS	0.0 alert
P-gp Substrate	No
Rotatable Bond Count	2
Synthetic Accessibility	1.81
Topological Polar Surface Area	19.03 Å²
Veber	0.0

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