In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 27 | Yes |
Popular Name: N-isopentyl-1-(1-isopropyl-4-piperidyl)-5-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide N-isopentyl-1-(1-isopropyl-4-pip…
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) | 3.61 | 9.14 | -47.82 | 2 | 5 | 1 | 51 | 389.486 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 6.93 | -10.69 | 1 | 5 | 0 | 50 | 388.478 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.