trivial
MDAT
systemic
5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxol-6-amine
MDAT
systemic
5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxol-6-amine
Identifiers
InChIKey: AWSBQWZZLBPUQH-UHFFFAOYSA-N
Formula: C11H13NO2
CAS Registry numbers:
101625-35-8
Descriptors
Bioavailability-related
Molecular weight: 191.09 DaPartition coefficient: 1.23
H bond donors: 2
H bond acceptors: 3
Rotatable bonds: 0
Molar refractivity: 52.57 J mol-1 K-1
Polar surface area: 44.48 Ă…2
Generic
Stereocenters: 1Heteroatoms: 3
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 0
Ring-related
Rings: 3Heterocycles: 1
Aromatic rings: 1
Aromatic carbocycles: 1
Aromatic heterocycles: 0
Aliphatic rings: 2
Aliphatic carbocycles: 1
Aliphatic heterocycles: 1