| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 10th, 2011 | 22 | Yes |
3-(3-Amino-3-carboxypropyl)-N6-(delta2-isopentenyl)-adenine; C01804; Discadenine
None
| 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) | -1.35 | 7.58 | -77.78 | 5 | 8 | 1 | 128 | 305.362 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.35 | 6.76 | -53.87 | 3 | 8 | -1 | 125 | 303.346 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.35 | 7.04 | -63.38 | 4 | 8 | 0 | 127 | 304.354 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
