| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 19 | Yes |
Popular Name: (1S,2R,5R)-2-(aminomethyl)-5-tert-butyl-N-(cyclopropylmethyl)-N-ethyl-cyclohexanamine (1S,2R,5R)-2-(aminomethyl)-5-ter…
| 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) | 3.50 | 8.33 | -106.07 | 4 | 2 | 2 | 32 | 268.489 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 7.96 | -30.86 | 3 | 2 | 1 | 30 | 267.481 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 6.91 | -45.64 | 3 | 2 | 1 | 31 | 267.481 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
