| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | Yes |
Popular Name: (1S)-N-[[(1R)-1-cyclohex-3-enyl]methyl]-N',N'-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N-[[(1R)-1-cyclohex-3-enyl]…
| 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) | 3.51 | 10.59 | -127.85 | 3 | 2 | 2 | 21 | 260.425 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.51 | 9.39 | -39.6 | 2 | 2 | 1 | 16 | 259.417 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 9.1 | -37.74 | 2 | 2 | 1 | 20 | 259.417 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
