| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 17 | Yes |
Popular Name: N-[(2S)-2-(4-ethylpiperazin-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(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) | 1.87 | 6.27 | -88.99 | 3 | 3 | 2 | 24 | 241.423 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 4.01 | -33.34 | 2 | 3 | 1 | 23 | 240.415 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 5.91 | -111.79 | 3 | 3 | 2 | 24 | 241.423 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
