In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 34 | No |
Popular Name: (5S)-4-(4-ethoxybenzoyl)-3-hydroxy-5-(3-nitrophenyl)-1-(3-pyridylmethyl)-5H-pyrrol-2-one (5S)-4-(4-ethoxybenzoyl)-3-hydro…
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) | 2.91 | 9.84 | -55.72 | 0 | 9 | -1 | 128 | 458.45 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.91 | 9.03 | -18.59 | 1 | 9 | 0 | 126 | 459.458 | 8 | ↓ |