| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 20 | No |
Popular Name: (3S)-3-[(2-methoxy-5-nitro-phenyl)methyl]pyrrolidine-3-carboxylic (3S)-3-[(2-methoxy-5-nitro-pheny…
| 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) | 1.29 | 6.39 | -59.15 | 2 | 7 | 0 | 112 | 280.28 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 5.4 | -43 | 1 | 7 | -1 | 107 | 279.272 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
