In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 20 | Yes |
Popular Name: N,1-dimethyl-N-[[2-(propylaminomethyl)-3-furyl]methyl]piperidin-4-amine N,1-dimethyl-N-[[2-(propylaminom…
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) | 1.78 | 9 | -197.87 | 4 | 4 | 3 | 39 | 282.452 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.78 | 6.6 | -107.34 | 3 | 4 | 2 | 37 | 281.444 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 6.5 | -88.06 | 3 | 4 | 2 | 37 | 281.444 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.