이름: 2-(pyrimidin-2-ylmethylsulfanyl)ethanamine
SMILES:
C1=CN=C(N=C1)CSCCNMolecular Processing
Molecular formula
C7H11N3S
Molecular weight
169.25
Exact mass
169.0674
XLogP
0.67
TPSA
51.8
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
47.25
Supplementary Information
InChIKey: CQPMAHTXYGMFGG-UHFFFAOYSA-N
동의어
SCHEMBL10859375CQPMAHTXYGMFGG-UHFFFAOYSA-NAKOS0119934772-[(2-aminoethyl)thiomethyl]pyrimidine2-[(2-aminoethyl)-thiomethyl]pyrimidine2-[(2-aminoethyl)thiomethyl]-pyrimidine
28개 반응에 참여→