In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2011 | 22 | Yes |
Popular Name: 5-[4-(2-pyrazol-1-ylethyl)piperazine-1-carbonyl]pyran-2-one 5-[4-(2-pyrazol-1-ylethyl)pipera…
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) | -0.43 | 5 | -15.67 | 0 | 7 | 0 | 72 | 302.334 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.43 | 7.22 | -59.51 | 1 | 7 | 1 | 73 | 303.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.