Cl.O=C1COc2ccc(CN[C@H]3CCN(CC4Cn5c(=O)ccc6ncc(F)c4c65)C[C@H]3F)nc2N1
SMILES: Cl.O=C1COc2ccc(CN[C@H]3CCN(CC4Cn5c(=O)ccc6ncc(F)c4c65)C[C@H]3F)nc2N1

Molecular Processing

Molecular formula
C24H25ClF2N6O3
Molecular weight
518.95
Exact mass
518.1645
XLogP
1.98
TPSA
101.38
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
36
Rings
6
Aromatic rings
3
Saturated rings
1
Aliphatic rings
3
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
2
Fraction Csp3
0.417
Molar refractivity
130.89

Supplementary Information

Details werden geladen…

An 1 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→