In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2011 | 16 | Yes |
Popular Name: (1S,2S)-2-(1-ethylimidazol-2-yl)-N-methyl-cycloheptanamine (1S,2S)-2-(1-ethylimidazol-2-yl)…
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) | 2.13 | 7.93 | -94.9 | 3 | 3 | 2 | 36 | 223.364 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 7.1 | -31.07 | 2 | 3 | 1 | 34 | 222.356 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.