| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2009 | 21 | Yes |
Popular Name: 4-methyl-2-[(1S)-1-[[(2S)-3-methyl-2-pyrrolidin-1-yl-butyl]amino]ethyl]phenol 4-methyl-2-[(1S)-1-[[(2S)-3-meth…
| 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) | 3.96 | 5.71 | -36.79 | 3 | 3 | 1 | 40 | 291.459 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.96 | 8.11 | -33.52 | 3 | 3 | 1 | 37 | 291.459 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.96 | 8.39 | -117.98 | 4 | 3 | 2 | 41 | 292.467 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
