In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 16 | Yes |
Popular Name: 1-[1-[[cyclobutylmethyl(methyl)amino]methyl]cyclopentyl]-N-methyl-methanamine 1-[1-[[cyclobutylmethyl(methyl)a…
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) | 2.65 | 8.6 | -103.11 | 3 | 2 | 2 | 21 | 226.408 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 7.37 | -33.82 | 2 | 2 | 1 | 16 | 225.4 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.65 | 6.59 | -35.27 | 2 | 2 | 1 | 20 | 225.4 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.