| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 20 | Yes |
Popular Name: (1S)-N'-(2-dimethylaminoethyl)-N'-isobutyl-1-phenyl-propane-1,3-diamine (1S)-N'-(2-dimethylaminoethyl)-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) | 0.88 | 7.82 | -101.06 | 4 | 3 | 2 | 35 | 279.472 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 8.94 | -107.33 | 4 | 3 | 2 | 35 | 279.472 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 5.36 | -45.95 | 3 | 3 | 1 | 34 | 278.464 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 6.47 | -32.93 | 3 | 3 | 1 | 34 | 278.464 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 6.93 | -120.39 | 4 | 3 | 2 | 35 | 279.472 | 9 | ↓ |
