(NZ)-N-(5a,6,7,8-tetrahydro-5H-pyren-4-ylidene)hydroxylamine

Formula:C16H15NO Mutagenic:none Tumorigenic:high Reproductive Effective:none (NZ)-N-(5a,6,7,8-tetrahydro-5H-pyren-4-ylidene)hydroxylamine is a drug-like molecule.

MolName(NZ)-N-(5a,6,7,8-tetrahydro-5H-pyren-4-ylidene)hydroxylamine
MolecularFormulaC16H15NO
SmilesO/N=C(/CC1CCC2)\c3cccc4ccc2c1c34
InChIInChI=1S/C16H15NO/c18-17-14-9-12-5-1-3-10-7-8-11-4-2-6-13(14)16(11)15(10)12/h2,4,6-8,12,18H,1,3,5,9H2/t12-/m1/s1
InChIKDPFZBMDNGHKSCI-GFCCVEGCSA-N
TotalMolweight237.301
Molweight237.301
MonoisotopicMass237.115364
CLogP4.8502
CLogS-5.557
H Acceptors2
H Donors1
TotalSurfaceArea177.72
Relative PSA0.13848
PolarSurfaceArea32.59
Druglikeness-4.0912
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.44444
Fragments1
Non HAtoms18
NonCHAtoms2
Electronegative Atoms2
StereoCenters1
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms10
Sp3Atoms6
StereoConracemate

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