In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 25 | Yes |
Popular Name: 1-(benzenesulfonyl)-8-oxo-5,9-dihydro-4H-pyrrolo[3,2-h]quinoline-7-carbonitrile 1-(benzenesulfonyl)-8-oxo-5,9-di…
None
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) | 1.80 | 7.35 | -23.36 | 1 | 6 | 0 | 96 | 351.387 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 6.16 | -58.76 | 0 | 6 | -1 | 99 | 350.379 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.