In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: (1R)-1-(2-furyl)-N,N-dimethyl-N'-(1-propyl-4-piperidyl)ethane-1,2-diamine (1R)-1-(2-furyl)-N,N-dimethyl-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) | 2.27 | 4.71 | -37.66 | 2 | 4 | 1 | 36 | 280.436 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 5.36 | -35.8 | 2 | 4 | 1 | 33 | 280.436 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 6.93 | -105.19 | 3 | 4 | 2 | 37 | 281.444 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 6.62 | -112.1 | 3 | 4 | 2 | 37 | 281.444 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.27 | 8.85 | -194.62 | 4 | 4 | 3 | 39 | 282.452 | 7 | ↓ |