In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2005 | 29 | Yes |
Popular Name: BRD-K69978976-001-04-2 BRD-K69978976-001-04-2
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) | 5.04 | 14.47 | -40.84 | 1 | 5 | 1 | 48 | 404.563 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.04 | 12.25 | -11.51 | 0 | 5 | 0 | 47 | 403.555 | 6 | ↓ |