In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2004 | 35 | Yes |
Popular Name: BRD-A81495244-001-01-5 BRD-A81495244-001-01-5
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) | 4.90 | 10.24 | -18.17 | 1 | 7 | 0 | 81 | 475.541 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.90 | 10.86 | -44.86 | 0 | 7 | -1 | 84 | 474.533 | 7 | ↓ |