Nombre: 7-[2-(2-Formamidothiazol-4-yl)-2-propargyloxyiminoacetamido]-3-[1-(2-hydroxyethyl)-1H-tetrazol-5-ylthiomethyl]-3-cephem-4-carboxylic acid
SMILES:
C#CCON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(C(CCO)Sc3nnn[nH]3)CS[C@H]12)c1csc(NC=O)n1Molecular Processing
Molecular formula
C20H19N9O7S3
Molecular weight
593.63
Exact mass
593.057
XLogP
-1.14
TPSA
224.98
H-bond donors
5
H-bond acceptors
14
Rotatable bonds
13
Heavy atoms
39
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
2
Formal charge
0
Heteroatoms
19
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
138.33
Supplementary Information
Obteniendo detalles…
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