In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 20th, 2014 | 17 | No |
Popular Name: 1-Deoxypentalenate; C20404 1-Deoxypentalenate; C20404
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) | 3.40 | 9.03 | -51.78 | 0 | 2 | -1 | 40 | 233.331 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.40 | 7.02 | -4.59 | 1 | 2 | 0 | 37 | 234.339 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.