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[ CAS No. 12266-92-1 ] {[proInfo.proName]}

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Chemical Structure| 12266-92-1
Chemical Structure| 12266-92-1
Structure of 12266-92-1 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 12266-92-1 ]

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Product Details of [ 12266-92-1 ]

CAS No. :12266-92-1 MDL No. :MFCD00064719
Formula : C10H18Pt Boiling Point : No data available
Linear Structure Formula :- InChI Key :AYLJSSIIYOOUOG-PHFPKPIQSA-N
M.W : 333.33 Pubchem ID :10882173
Synonyms :

Calculated chemistry of [ 12266-92-1 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 11
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.6
Num. rotatable bonds : 0
Num. H-bond acceptors : 0.0
Num. H-bond donors : 0.0
Molar Refractivity : 49.24
TPSA : 0.0 ?2

Pharmacokinetics

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) : -5.17 cm/s

Lipophilicity

Log Po/w (iLOGP) : 0.0
Log Po/w (XLOGP3) : 4.46
Log Po/w (WLOGP) : 3.84
Log Po/w (MLOGP) : 3.27
Log Po/w (SILICOS-IT) : 2.28
Consensus Log Po/w : 2.77

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 1.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -4.72
Solubility : 0.0064 mg/ml ; 0.0000192 mol/l
Class : Moderately soluble
Log S (Ali) : -4.18
Solubility : 0.0221 mg/ml ; 0.0000662 mol/l
Class : Moderately soluble
Log S (SILICOS-IT) : -1.1
Solubility : 26.3 mg/ml ; 0.0789 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 3.43

Safety of [ 12266-92-1 ]

Signal Word:Warning Class:
Precautionary Statements:P261-P305+P351+P338 UN#:
Hazard Statements:H315-H319-H335 Packing Group:
GHS Pictogram:
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