| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 19 | Yes |
Popular Name: (1S)-N'-(1,3-benzodioxol-4-ylmethyl)-1-cyclopropyl-N,N-dimethyl-ethane-1,2-diamine (1S)-N'-(1,3-benzodioxol-4-ylmet…
None
| 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) | 2.25 | 5.94 | -38.98 | 2 | 4 | 1 | 38 | 263.361 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 7.23 | -118.29 | 3 | 4 | 2 | 40 | 264.369 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 5.84 | -36.72 | 2 | 4 | 1 | 35 | 263.361 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
