In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 18 | Yes |
Popular Name: 6-(piperazin-1-ylmethyl)-3,4-dihydro-1H-quinolin-2-one 6-(piperazin-1-ylmethyl)-3,4-dih…
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) | 0.70 | 2.8 | -45.95 | 3 | 4 | 1 | 49 | 246.334 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 1.45 | -7.03 | 2 | 4 | 0 | 44 | 245.326 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.