2-Amino-4-chloro-6-hydroxy-5-nitropyrimidine

2-Amino-4-chloro-6-hydroxy-5-nitropyrimidine

Cat. No.: PI1007994

2-Amino-4-chloro-6-hydroxy-5-nitropyrimidine
Product Details Other Identifiers Computed Properties
CAS 1007-99-4
Purity 98%
Molecular Formula C4H3ClN4O3
Molecular Weight 190.54
Molar Refractivity 42.29
Pubchem ID 135408693
InChI Key UTTPUMOOQSNOHH-UHFFFAOYSA-N
MDL Number MFCD07367841
Aromatic Heavy Atoms Number 6
BBB Permeant No
Bioavailability Score 0.55
Brenk 2.0 alert
Consensus Log Po/w -0.01
CYP1A2Inhibitor No
CYP2C19Inhibitor No
CYP2C9Inhibitor No
CYP2D6Inhibitor No
CYP3A4Inhibitor No
Egan 0.0
Fraction Csp3 0.0
Ghose None
GI Absorption High
Heavy Atom Count 12
Hydrogen Bond Acceptor Count 5.0
Hydrogen Bond Donor Count 2.0
Leadlikeness 1.0
Lipinski 0.0
Log Kp (Skin Permeation) -6.63 cm/s
Log Po/w (iLOGP) 0.34
Log Po/w (MLOGP) -0.39
Log Po/w (SILICOS-IT) -1.48
Log Po/w (WLOGP) 0.33
Log Po/w (XLOGP3) 1.17
Muegge 2.0
PAINS 0.0 alert
P-gp Substrate No
Rotatable Bond Count 1
Synthetic Accessibility 2.18
Topological Polar Surface Area 117.85 Ų
Veber 0.0

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