In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2007 | 33 | No |
Popular Name: BRD-A68596543-001-01-5 BRD-A68596543-001-01-5
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) | 1.64 | 5.56 | -63.95 | 0 | 8 | -1 | 95 | 470.571 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 4.65 | -48.79 | 2 | 8 | 1 | 93 | 472.587 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 7.9 | -86.35 | 1 | 8 | 0 | 96 | 471.579 | 8 | ↓ |