In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 18 | Yes |
Popular Name: N-[(1R)-1-cyclohexylethyl]-2-(4-methyl-1-piperidyl)ethanamine N-[(1R)-1-cyclohexylethyl]-2-(4-…
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) | 3.90 | 9.73 | -115.99 | 3 | 2 | 2 | 21 | 254.462 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.90 | 7.5 | -36.89 | 2 | 2 | 1 | 20 | 253.454 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.90 | 8.56 | -32.26 | 2 | 2 | 1 | 16 | 253.454 | 5 | ↓ |