Cc1ccc2c(N3CCC(OC(=O)NCC(C)C)CC3)nc(-c3ccccc3O)nc2c1
SMILES: Cc1ccc2c(N3CCC(OC(=O)NCC(C)C)CC3)nc(-c3ccccc3O)nc2c1

Molecular Processing

Molecular formula
C25H30N4O3
Molecular weight
434.54
Exact mass
434.2318
XLogP
4.66
TPSA
87.58
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
125.93

Supplementary Information

Details werden geladen…

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