In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 18 | Yes |
Popular Name: (1R)-N-[[(1R)-cyclohex-3-en-1-yl]methyl]-1-[(3S)-1-ethyl-3-piperidyl]ethanamine (1R)-N-[[(1R)-cyclohex-3-en-1-yl…
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) | 3.41 | 9.55 | -100.94 | 3 | 2 | 2 | 21 | 252.446 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.41 | 8.52 | -31.17 | 2 | 2 | 1 | 16 | 251.438 | 5 | ↓ |