Name: N-(4-(1H-imidazol-1-yl)butyl)benz(cd)indol-2-amine, monohydroiodide
SMILES:
I.c1cc2c3c(cccc3c1)C(NCCCCn1ccnc1)=N2Molecular Processing
Molecular formula
C18H19IN4
Molecular weight
418.28
Exact mass
418.0654
XLogP
4.12
TPSA
42.21
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
23
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.222
Molar refractivity
105.02
Supplementary Information
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