In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 21 | 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) | 3.58 | 0.63 | -15.11 | 1 | 3 | 0 | 41 | 276.339 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 0.27 | -32.07 | 2 | 3 | 1 | 43 | 277.347 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.