In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 21 | Yes |
Popular Name: 3-amino-N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-2-methyl-benzamide 3-amino-N-[1-(2-amino-2-oxo-ethy…
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) | 0.12 | 1.72 | -43.78 | 6 | 6 | 1 | 103 | 291.375 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.12 | -0.47 | -12.5 | 5 | 6 | 0 | 101 | 290.367 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.