In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 19 | Yes |
Popular Name: 4-(aminomethyl)-1-isopropyl-N-methyl-N-[(1S)-1,2,2-trimethylpropyl]piperidin-4-amine 4-(aminomethyl)-1-isopropyl-N-me…
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) | 2.34 | 5.52 | -105.96 | 4 | 3 | 2 | 35 | 271.493 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 6.99 | -93.27 | 4 | 3 | 2 | 35 | 271.493 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 5.5 | -33.13 | 3 | 3 | 1 | 34 | 270.485 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.34 | 6.91 | -217.2 | 5 | 3 | 3 | 37 | 272.501 | 5 | ↓ |