In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 26 | 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) | -1.02 | -1.53 | -62.46 | 6 | 8 | 1 | 127 | 366.438 | 9 | ↓ |
Hi High (pH 8-9.5) | -1.02 | -1.99 | -16.79 | 5 | 8 | 0 | 125 | 365.43 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.