In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 26 | No |
Popular Name: BRD-A76049689-001-01-9 BRD-A76049689-001-01-9
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) | 2.29 | 3.09 | -19.14 | 1 | 7 | 0 | 97 | 367.386 | 4 | ↓ |
Ref Reference (pH 7) | 3.79 | -0.8 | -14.23 | 3 | 7 | 0 | 105 | 367.386 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.79 | -0.03 | -53.01 | 2 | 7 | -1 | 107 | 366.378 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.79 | -0.03 | -62.38 | 2 | 7 | -1 | 107 | 366.378 | 4 | ↓ |