In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 19 | Yes |
Popular Name: N-[[1-(3-imidazol-1-ylpropyl)-4-piperidyl]methyl]propan-2-amine N-[[1-(3-imidazol-1-ylpropyl)-4-…
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) | 1.53 | 10.46 | -162.77 | 4 | 4 | 3 | 40 | 267.441 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.53 | 7.72 | -42.09 | 2 | 4 | 1 | 38 | 265.425 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 9.95 | -106.72 | 3 | 4 | 2 | 39 | 266.433 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.