In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2010 | 43 | No |
Popular Name: BRD-A15476552-001-01-2 BRD-A15476552-001-01-2
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) | 2.08 | 7.19 | -16.75 | 3 | 10 | 0 | 118 | 581.673 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.08 | 7.84 | -47.89 | 2 | 10 | -1 | 121 | 580.665 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 9.41 | -52.33 | 4 | 10 | 1 | 119 | 582.681 | 4 | ↓ |