In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: N,N-diisopropyl-N'-[(1S)-1-[(3S)-1-methyl-3-piperidyl]ethyl]ethane-1,2-diamine N,N-diisopropyl-N'-[(1S)-1-[(3S)…
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) | 2.61 | 7.85 | -74.56 | 3 | 3 | 2 | 21 | 271.493 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 5.93 | -33.39 | 2 | 3 | 1 | 20 | 270.485 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.61 | 9.04 | -181.29 | 4 | 3 | 3 | 25 | 272.501 | 7 | ↓ |