In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 19 | Yes |
Popular Name: 3-amino-N-(1-ethyl-4-piperidyl)-1-methyl-pyrazole-4-sulfonamide 3-amino-N-(1-ethyl-4-piperidyl)-…
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) | -0.21 | 1.21 | -46.15 | 4 | 7 | 1 | 94 | 288.397 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.21 | -1.04 | -11.5 | 3 | 7 | 0 | 93 | 287.389 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.