In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 22 | Yes |
Popular Name: N-[2-[1-(2-aminoacetyl)-4-piperidyl]pyrazol-3-yl]-2,2-dimethyl-propanamide N-[2-[1-(2-aminoacetyl)-4-piperi…
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) | -0.06 | 3.83 | -58.16 | 4 | 7 | 1 | 95 | 308.406 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.06 | 3.43 | -18.07 | 3 | 7 | 0 | 93 | 307.398 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.