In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 51 | No |
Popular Name: BRD-A81177136-001-04-4 BRD-A81177136-001-04-4
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) | 5.08 | 13.07 | -34.26 | 0 | 11 | 0 | 130 | 721.861 | 10 | ↓ |
Lo Low (pH 4.5-6) | 5.08 | 13.46 | -68.67 | 1 | 11 | 1 | 131 | 722.869 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.