| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | Yes |
Popular Name: (2S)-1-(diethylamino)-3-[[3-(dimethylamino)-2,2-dimethyl-propyl]amino]propan-2-ol (2S)-1-(diethylamino)-3-[[3-(dim…
| 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) | 1.07 | 5.97 | -172.1 | 5 | 4 | 3 | 46 | 262.462 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 5.36 | -53.2 | 3 | 4 | 1 | 44 | 260.446 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 6.46 | -94.52 | 4 | 4 | 2 | 49 | 261.454 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.07 | 4.8 | -74.49 | 4 | 4 | 2 | 41 | 261.454 | 10 | ↓ |
