2-chloro-N-[2-(cyclohexen-1-yl)ethyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine

Formula:C14H17N4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-chloro-N-[2-(cyclohexen-1-yl)ethyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine is a drug-like molecule.

MolName	2-chloro-N-[2-(cyclohexen-1-yl)ethyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine
MolecularFormula	C14H17N4Cl
Smiles	Clc1nc(NCCC2=CCCCC2)c2[nH]ccc2n1
InChI	InChI=1S/C14H17ClN4/c15-14-18-11-7-9-16-12(11)13(19-14)17-8-6-10-4-2-1-3-5-10/h4,7,9,16H,1-3,5-6,8H2,(H,17,18,19)
InChIK	HWKUUNFBRUEKJZ-UHFFFAOYSA-N
TotalMolweight	276.77
Molweight	276.77
MonoisotopicMass	276.114173
CLogP	3.2051
CLogS	-3.754
H Acceptors	4
H Donors	2
TotalSurfaceArea	215.6
Relative PSA	0.21981
PolarSurfaceArea	53.6
Druglikeness	-5.0369
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57895
Fragments	1
Non HAtoms	19
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	9
Sp3Atoms	6
Aromatic Nitrogens	3
StereoCon

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