In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 19 | Yes |
Popular Name: N,1-dimethyl-N-[[4-methyl-5-(methylaminomethyl)-2-furyl]methyl]piperidin-4-amine N,1-dimethyl-N-[[4-methyl-5-(met…
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) | 1.59 | 8.27 | -164.75 | 4 | 4 | 3 | 39 | 268.425 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 5.79 | -81.63 | 3 | 4 | 2 | 37 | 267.417 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 5.87 | -90.29 | 3 | 4 | 2 | 37 | 267.417 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.