In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 22 | No |
Popular Name: BRD-K95073410-001-01-0 BRD-K95073410-001-01-0
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) | 2.21 | 5.47 | -19.78 | 1 | 7 | 0 | 94 | 300.27 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 5.77 | -62.94 | 0 | 7 | -1 | 97 | 299.262 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 6.6 | -70.34 | 0 | 7 | -1 | 97 | 299.262 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 5.53 | -20 | 1 | 7 | 0 | 94 | 300.27 | 5 | ↓ |