In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 28 | Yes |
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) | 2.93 | 1.94 | -22.31 | 3 | 8 | 0 | 117 | 399.476 | 4 | ↓ |
Ref Reference (pH 7) | 2.74 | 4.59 | -24.16 | 3 | 8 | 0 | 113 | 399.476 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.