In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: (1S)-1-(1-ethyl-4-piperidyl)-N-(2-morpholinoethyl)ethanamine (1S)-1-(1-ethyl-4-piperidyl)-N-(…
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) | 1.48 | 4.84 | -98.52 | 3 | 4 | 2 | 34 | 271.449 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.48 | 3.81 | -33.99 | 2 | 4 | 1 | 29 | 270.441 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.48 | 7.11 | -189.55 | 4 | 4 | 3 | 35 | 272.457 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.