이름: 6-(5-methyl-3-pyrimidin-4-yl-isoxazol-4-ylmethoxy)-nicotinic acid
SMILES:
Cc1onc(-c2ccncn2)c1COc1ccc(C(=O)O)cn1Molecular Processing
Molecular formula
C15H12N4O4
Molecular weight
312.29
Exact mass
312.0859
XLogP
2.11
TPSA
111.23
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
77.79
Supplementary Information
상세 정보 불러오는 중…
40개 반응에 참여→