| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 17 | Yes |
Popular Name: (3S)-N3-(cyclohexylmethyl)-N1-cyclopropyl-N3-methyl-butane-1,3-diamine (3S)-N3-(cyclohexylmethyl)-N1-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) | 3.38 | 9.41 | -104.1 | 3 | 2 | 2 | 21 | 240.435 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 8.12 | -32.34 | 2 | 2 | 1 | 16 | 239.427 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Cyclohexylmethyl-[3-(cyclopropylamino)propyl]amine](http://zinc12.docking.org/img/rings/122852.gif)