| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 20 | Yes |
Popular Name: (1S,2R)-N'-ethyl-2-methyl-1-phenyl-N'-[[(2S)-tetrahydrofuran-2-yl]methyl]propane-1,3-diamine (1S,2R)-N'-ethyl-2-methyl-1-phen…
| 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) | 0.95 | 5.71 | -44.52 | 3 | 3 | 1 | 40 | 277.432 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.95 | 7.28 | -34.65 | 3 | 3 | 1 | 40 | 277.432 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.95 | 7.6 | -114.48 | 4 | 3 | 2 | 41 | 278.44 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
