In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2006 | 25 | Yes |
Popular Name: BRD-K44099612-001-01-3 BRD-K44099612-001-01-3
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) | 3.43 | 7.13 | -24.61 | 2 | 6 | 0 | 80 | 358.398 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.43 | 6.97 | -49.25 | 1 | 6 | -1 | 78 | 357.39 | 6 | ↓ |