In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: (1S)-N-[[(1R)-cyclohex-3-en-1-yl]methyl]-1-[(3R)-1-methyl-3-piperidyl]ethanamine (1S)-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) | 3.03 | 8.93 | -100.31 | 3 | 2 | 2 | 21 | 238.419 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.03 | 7.94 | -33.32 | 2 | 2 | 1 | 16 | 237.411 | 4 | ↓ |