In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 30 | Yes |
Popular Name: BRD-A49652836-001-01-6 BRD-A49652836-001-01-6
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) | 4.81 | 9.67 | -15.22 | 1 | 7 | 0 | 91 | 414.454 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.81 | 10.21 | -54.64 | 0 | 7 | -1 | 94 | 413.446 | 6 | ↓ |