이름: 2-amino-5-(tert-butoxycarbonylamino-methyl)-benzoic acid
SMILES:
CC(C)(C)OC(=O)NCc1ccc(N)c(C(=O)O)c1Molecular Processing
Molecular formula
C13H18N2O4
Molecular weight
266.3
Exact mass
266.1267
XLogP
1.99
TPSA
101.65
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
70.89
Supplementary Information
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