Название: 6,7-dihydro-5-(4-amino-2-chlorobenzoyl)-5H-pyrrolo-[1,2-a][1,5]benzodiazepine
SMILES:
Nc1ccc(C(=O)N2CCc3cccn3-c3ccccc32)c(Cl)c1Molecular Processing
Molecular formula
C19H16ClN3O
Molecular weight
337.81
Exact mass
337.0982
XLogP
3.92
TPSA
51.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.105
Molar refractivity
97.01
Supplementary Information
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