In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 18 | Yes |
Popular Name: 4-(aminomethyl)-1-isopropyl-N,N-dipropyl-piperidin-4-amine 4-(aminomethyl)-1-isopropyl-N,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) | 2.07 | 4.78 | -27.33 | 3 | 3 | 1 | 34 | 256.458 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 7.18 | -92.58 | 4 | 3 | 2 | 35 | 257.466 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 5.22 | -29.37 | 3 | 3 | 1 | 34 | 256.458 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.07 | 5.42 | -108.4 | 4 | 3 | 2 | 35 | 257.466 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 4.9 | -115.09 | 4 | 3 | 2 | 35 | 257.466 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 7.29 | -215.75 | 5 | 3 | 3 | 37 | 258.474 | 7 | ↓ |