In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2004 | 29 | Yes |
Popular Name: BRD-K81232354-001-01-6 BRD-K81232354-001-01-6
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) | 2.25 | 1.72 | -55.42 | 1 | 9 | -1 | 122 | 413.435 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.25 | 2.23 | -17.53 | 2 | 9 | 0 | 120 | 414.443 | 7 | ↓ |