| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 18 | Yes |
Popular Name: (1S)-N',N'-dimethyl-1-phenyl-N-[[(3S)-tetrahydrofuran-3-yl]methyl]ethane-1,2-diamine (1S)-N',N'-dimethyl-1-phenyl-N-[…
| 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) | 2.20 | 7.58 | -120.7 | 3 | 3 | 2 | 30 | 250.386 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 5.19 | -44.98 | 2 | 3 | 1 | 29 | 249.378 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 6.33 | -38.31 | 2 | 3 | 1 | 26 | 249.378 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
