이름: 6-(1-aminopropyl)-3-cyclopropyl-4H-1,2,4-triazin-5-one
SMILES:
CCC(C1=NN=C(NC1=O)C2CC2)NMolecular Processing
Molecular formula
C9H14N4O
Molecular weight
194.24
Exact mass
194.1168
XLogP
0.45
TPSA
84.66
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
51.85
Supplementary Information
InChIKey: OWLUXOZTCYRDQS-UHFFFAOYSA-N
동의어
SCHEMBL5846004OWLUXOZTCYRDQS-UHFFFAOYSA-N6-(1-aminopropyl)-3-cyclopropyl-1,2,4-triazin-5(4h)-one6-(1-aminopropyl)-3-cyclopropyl-1.2,4-triazin-5(4h)-one6-(1-amino-propyl)-3-cyclopropyl-1,2,4-triazin-5(4h)-one
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