In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 2011 | 39 | No |
Popular Name: BRD-K56024114-001-01-9 BRD-K56024114-001-01-9
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) | 1.98 | 3.64 | -17.21 | 3 | 11 | 0 | 124 | 547.697 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 5.91 | -48.12 | 4 | 11 | 1 | 125 | 548.705 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.