In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2010 | 27 | Yes |
Popular Name: (2,3-dimethylquinoxalin-6-yl)-[4-(2-pyridylmethyl)piperazin-1-yl]methanone (2,3-dimethylquinoxalin-6-yl)-[4…
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) | 1.24 | 5.71 | -13.22 | 0 | 6 | 0 | 62 | 361.449 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.24 | 5.72 | -41.02 | 1 | 6 | 1 | 63 | 362.457 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 7.95 | -46.4 | 1 | 6 | 1 | 63 | 362.457 | 3 | ↓ |