| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 19 | No |
Popular Name: N-[2-[4-(cyclopropylmethyl)piperazin-1-yl]ethyl]-2-methylsulfonyl-ethanamine N-[2-[4-(cyclopropylmethyl)piper…
| 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) | -0.06 | 2.73 | -106.75 | 3 | 5 | 2 | 58 | 291.461 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.06 | -0.9 | -12.3 | 1 | 5 | 0 | 53 | 289.445 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.06 | 1.37 | -43.27 | 2 | 5 | 1 | 54 | 290.453 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
