In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 22 | Yes |
Popular Name: BRD-K16309743-001-01-2 BRD-K16309743-001-01-2
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 | 7.14 | -38.72 | 1 | 4 | 1 | 30 | 298.41 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 7.2 | -37.4 | 1 | 4 | 1 | 30 | 298.41 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 4.8 | -6.3 | 0 | 4 | 0 | 29 | 297.402 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.80 | 7.42 | -82.78 | 2 | 4 | 2 | 31 | 299.418 | 5 | ↓ |