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(NZ)-N-[dimorpholin-4-ylphosphoryl-[4-[(Z)-C-dimorpholin-4-ylphosphoryl-N-hydroxycarbonimidoyl]piperazin-1-yl]methylidene]hydroxylamine

Formula:C22H42N8O8P2 Mutagenic:high Tumorigenic:high Reproductive Effective:low (NZ)-N-[dimorpholin-4-ylphosphoryl-[4-[(Z)-C-dimorpholin-4-ylphosphoryl-N-hydroxycarbonimidoyl]piperazin-1-yl]methylidene]hydroxylamine is not a drug-like molecule.
MolName(NZ)-N-[dimorpholin-4-ylphosphoryl-[4-[(Z)-C-dimorpholin-4-ylphosphoryl-N-hydroxycarbonimidoyl]piperazin-1-yl]methylidene]hydroxylamine
MolecularFormulaC22H42N8O8P2
SmilesO/N=C(/N(CC1)CCN1/C(/P(N1CCOCC1)(N1CCOCC1)=O)=N/O)\P(N1CCOCC1)(N1CCOCC1)=O
InChIInChI=1S/C22H42N8O8P2/c31-23-21(39(33,27-5-13-35-14-6-27)28-7-15-36-16-8-28)25-1-2-26(4-3-25)22(24-32)40(34,29-9-17-37-18-10-29)30-11-19-38-20-12-30/h31-32H,1-20H2
InChIKRNXYESQNFYYYBJ-UHFFFAOYSA-N
TotalMolweight608.571
Molweight608.571
MonoisotopicMass608.260086
CLogP-0.4008
CLogS-1.646
H Acceptors16
H Donors2
TotalSurfaceArea429.18
Relative PSA0.33683
PolarSurfaceArea175.3
Druglikeness-7.2615
Mutagenichigh
Tumorigenichigh
Reproductive Effectivelow
Irritantnone
Nasty Functions
Shape Index0.4
Fragments1
Non HAtoms40
NonCHAtoms18
Electronegative Atoms18
Rotatable Bond2
Rings Closures5
Small Rings5
Sp3Atoms28
Symmetricatoms29
StereoCon

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