In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: (4S)-N-[(1R)-1-(1-propyl-4-piperidyl)ethyl]-4,5,6,7-tetrahydrobenzofuran-4-amine (4S)-N-[(1R)-1-(1-propyl-4-piper…
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) | 2.56 | 9.21 | -98.62 | 3 | 3 | 2 | 34 | 292.467 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 8.66 | -35.41 | 2 | 3 | 1 | 30 | 291.459 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.