In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2010 | 17 | Yes |
Popular Name: (2S)-1-(diisobutylamino)-3-(isopropylamino)propan-2-ol (2S)-1-(diisobutylamino)-3-(isop…
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) | 2.40 | 5.94 | -99.34 | 4 | 3 | 2 | 41 | 246.439 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.40 | 6.3 | -38.34 | 3 | 3 | 1 | 44 | 245.431 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.40 | 4.67 | -32.61 | 3 | 3 | 1 | 37 | 245.431 | 9 | ↓ |