3-[(Z)-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenol

Formula:C18H23N7O Mutagenic:high Tumorigenic:high Reproductive Effective:high 3-[(Z)-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenol is a drug-like molecule.

MolName	3-[(Z)-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenol
MolecularFormula	C18H23N7O
Smiles	Oc1cc(/C=N\Nc2nc(N3CCCC3)nc(N3CCCC3)n2)ccc1
InChI	InChI=1S/C18H23N7O/c26-15-7-5-6-14(12-15)13-19-23-16-20-17(24-8-1-2-9-24)22-18(21-16)25-10-3-4-11-25/h5-7,12-13,26H,1-4,8-11H2,(H,20,21,22,23)
InChIK	MMURWQDCHJYWKX-UHFFFAOYSA-N
TotalMolweight	353.429
Molweight	353.429
MonoisotopicMass	353.196408
CLogP	4.8988
CLogS	-4.483
H Acceptors	8
H Donors	2
TotalSurfaceArea	275.55
Relative PSA	0.2761
PolarSurfaceArea	89.77
Druglikeness	4.0845
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	9
Symmetricatoms	9
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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