In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2005 | 26 | Yes |
Popular Name: BRD-A80352954-001-01-9 BRD-A80352954-001-01-9
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) | 4.21 | 9.03 | -36 | 3 | 4 | 1 | 59 | 342.422 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 9.34 | -51.34 | 1 | 4 | -1 | 61 | 340.406 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.21 | 8.56 | -9.79 | 2 | 4 | 0 | 58 | 341.414 | 4 | ↓ |