| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2009 | 28 | No |
Popular Name: (2S)-1-[(2R)-2-aminopropyl]-3-benzoyl-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one (2S)-1-[(2R)-2-aminopropyl]-3-be…
| 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) | 1.54 | 7.18 | -58.03 | 3 | 8 | 0 | 134 | 381.388 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 6.8 | -56.77 | 2 | 8 | -1 | 132 | 380.38 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.54 | 6.41 | -54.92 | 4 | 8 | 1 | 131 | 382.396 | 6 | ↓ |
