| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 20 | Yes |
Popular Name: (1S,2S,4R)-N2-cyclopropyl-4-phenyl-N2-propyl-cyclohexane-1,2-diamine (1S,2S,4R)-N2-cyclopropyl-4-phen…
| 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) | 3.18 | 8.65 | -112.07 | 4 | 2 | 2 | 32 | 274.452 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.18 | 8.98 | -31.36 | 3 | 2 | 1 | 30 | 273.444 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.18 | 7.15 | -37.24 | 3 | 2 | 1 | 31 | 273.444 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
