In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2011 | 21 | Yes |
Popular Name: (4R)-2,6,6-trimethyl-N-[(1R)-1-(3-methyl-2-thienyl)ethyl]-5,7-dihydro-4H-benzofuran-4-amine (4R)-2,6,6-trimethyl-N-[(1R)-1-(…
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) | 3.89 | 9.83 | -35.14 | 2 | 2 | 1 | 30 | 304.479 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.89 | 8.83 | -4.74 | 1 | 2 | 0 | 25 | 303.471 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.