In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 28 | Yes |
Popular Name: BRD-K05084492-003-01-3 BRD-K05084492-003-01-3
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) | 5.85 | 14.86 | -93.36 | 2 | 4 | 2 | 35 | 376.548 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.85 | 12.3 | -8.01 | 0 | 4 | 0 | 32 | 374.532 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.85 | 14.86 | -78.97 | 2 | 4 | 2 | 35 | 376.548 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.