In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 18 | Yes |
Popular Name: 1-[(1S,2R)-2-ethylcyclohexyl]-N-propyl-piperidin-4-amine 1-[(1S,2R)-2-ethylcyclohexyl]-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) | 4.05 | 8.18 | -31.07 | 2 | 2 | 1 | 16 | 253.454 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.05 | 7.59 | -35.68 | 2 | 2 | 1 | 20 | 253.454 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.05 | 9.36 | -103.92 | 3 | 2 | 2 | 21 | 254.462 | 5 | ↓ |