| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | Yes |
Popular Name: 1-[(2S)-1-ethylpyrrolidin-2-yl]-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]methanamine 1-[(2S)-1-ethylpyrrolidin-2-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) | 1.21 | 3.76 | -43.2 | 2 | 5 | 1 | 55 | 225.316 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 3.32 | -49.93 | 2 | 5 | 1 | 59 | 225.316 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 1.98 | -7.92 | 1 | 5 | 0 | 54 | 224.308 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 5.13 | -131.46 | 3 | 5 | 2 | 60 | 226.324 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
