| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2005 | 35 | Yes |
Popular Name: CC[C@@]1(c2cc-3n(c(=O)c2COC1=O)[C@@H](c4c3nc5ccc(c(c5c4)CN(C)C)O)OCCO)O CC[C@@]1(c2cc-3n(c(=O)c2COC1=O)[…
| 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) | 1.26 | -6.53 | -56.28 | 4 | 10 | 1 | 135 | 482.513 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.26 | -6.48 | -113.21 | 5 | 10 | 2 | 136 | 483.521 | 6 | ↓ |
