In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 29 | 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) | 3.56 | 5.25 | -57.72 | 2 | 6 | -1 | 102 | 407.402 | 2 | ↓ |
Ref Reference (pH 7) | 3.38 | 7.86 | -52.23 | 2 | 6 | -1 | 98 | 407.402 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.