| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 17 | Yes |
Popular Name: (1R,2S,5R)-2-(aminomethyl)-N-(cyclopropylmethyl)-N,5-diethyl-cyclohexanamine (1R,2S,5R)-2-(aminomethyl)-N-(cy…
| 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) | 2.86 | 7.77 | -109.79 | 4 | 2 | 2 | 32 | 240.435 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 7.4 | -29.68 | 3 | 2 | 1 | 30 | 239.427 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 6.2 | -42.89 | 3 | 2 | 1 | 31 | 239.427 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
