In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 19 | Yes |
Popular Name: 3-[4-[(1R)-1-methylpropyl]piperazin-1-yl]pyrazine-2-carboxylic 3-[4-[(1R)-1-methylpropyl]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) | 1.37 | 6.98 | -54.09 | 1 | 6 | 0 | 74 | 264.329 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 5.13 | -52.19 | 0 | 6 | -1 | 72 | 263.321 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.