In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 21 | Yes |
Popular Name: 3-amino-N-(1-ethyl-4-piperidyl)-1-propyl-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) | 0.66 | 2.77 | -45.23 | 4 | 7 | 1 | 94 | 316.451 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.66 | 0.52 | -10.56 | 3 | 7 | 0 | 93 | 315.443 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.