| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 20 | Yes |
Popular Name: (1S,2S)-N1,N2-dimethyl-1-phenyl-N2-[[(2S)-tetrahydrofuran-2-yl]methyl]butane-1,2-diamine (1S,2S)-N1,N2-dimethyl-1-phenyl-…
| 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) | 2.95 | 8.1 | -111.4 | 3 | 3 | 2 | 30 | 278.44 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 5.41 | -2.63 | 1 | 3 | 0 | 24 | 276.424 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.95 | 6.38 | -31.09 | 2 | 3 | 1 | 29 | 277.432 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.95 | 6.93 | -32.35 | 2 | 3 | 1 | 26 | 277.432 | 7 | ↓ |
