| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 16 | Yes |
Popular Name: N-[(3S)-3-(4-ethylpiperazin-1-yl)butyl]cyclopropanamine N-[(3S)-3-(4-ethylpiperazin-1-yl…
| 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) | 1.36 | 5.87 | -84.26 | 3 | 3 | 2 | 24 | 227.396 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 3.59 | -35.24 | 2 | 3 | 1 | 23 | 226.388 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.36 | 5.49 | -102.41 | 3 | 3 | 2 | 24 | 227.396 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
