In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | No |
Popular Name: (4S)-2,6,6-trimethyl-N-[(3R)-tetrahydrothiophen-3-yl]-5,7-dihydro-4H-benzofuran-4-amine (4S)-2,6,6-trimethyl-N-[(3R)-tet…
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) | 2.30 | 8.24 | -41.63 | 2 | 2 | 1 | 30 | 266.43 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.30 | 7.22 | -4.56 | 1 | 2 | 0 | 25 | 265.422 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.