In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 17 | Yes |
Popular Name: 4-(aminomethyl)-1-ethyl-N,N-dipropyl-piperidin-4-amine 4-(aminomethyl)-1-ethyl-N,N-dipr…
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) | 1.77 | 4.41 | -27.45 | 3 | 3 | 1 | 34 | 242.431 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 4.55 | -114.22 | 4 | 3 | 2 | 35 | 243.439 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 6.64 | -93.07 | 4 | 3 | 2 | 35 | 243.439 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 4.83 | -31.99 | 3 | 3 | 1 | 34 | 242.431 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 4.91 | -108.94 | 4 | 3 | 2 | 35 | 243.439 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.77 | 6.61 | -214.43 | 5 | 3 | 3 | 37 | 244.447 | 7 | ↓ |