In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2008 | 23 | No |
Popular Name: BRD-K15207598-001-05-6 BRD-K15207598-001-05-6
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) | 4.40 | 6.82 | -8.22 | 1 | 4 | 0 | 54 | 324.405 | 4 | ↓ |
Ref Reference (pH 7) | 3.47 | 6.87 | -13.64 | 1 | 4 | 0 | 51 | 324.405 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.86 | 4.77 | -47.61 | 0 | 4 | -1 | 58 | 323.397 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.86 | 5.11 | -47.8 | 0 | 4 | -1 | 58 | 323.397 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.47 | 5.87 | -44.43 | 0 | 4 | -1 | 53 | 323.397 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.47 | 7.86 | -32.48 | 2 | 4 | 1 | 52 | 325.413 | 5 | ↓ |