In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2015 | 35 | 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) | -0.76 | 5.05 | -68.34 | 8 | 11 | 0 | 189 | 510.661 | 11 | ↓ |
Mid Mid (pH 6-8) | -0.76 | 4.64 | -62.6 | 9 | 11 | 1 | 187 | 511.669 | 11 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Indications | anticoagulant | KeyOrganics Bioactives |
No pre-computed analogs available. Try a structural similarity search.