In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 21 | Yes |
Popular Name: (3aS,6S,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-3,4,5,6,7,7a-hexahydro-2H-indol-6-amine (3aS,6S,7aS)-3a-(3,4-dimethoxyph…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.31 | 3.47 | -53.29 | 3 | 4 | 1 | 49 | 291.415 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.31 | 5.44 | -116.93 | 4 | 4 | 2 | 51 | 292.423 | 3 | ↓ |