| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 27 | No |
Popular Name: (2Z)-6-hydroxy-2-(4-nitrobenzylidene)-7-(pyrrolidin-1-ium-1-ylmethyl)coumaran-3-one (2Z)-6-hydroxy-2-(4-nitrobenzyli…
| 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) | 3.29 | 9.47 | -47.53 | 2 | 7 | 1 | 101 | 367.381 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.29 | 10.23 | -30.73 | 1 | 7 | 0 | 104 | 366.373 | 4 | ↓ |
