In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 10th, 2004 | 26 | No |
Popular Name: (5S)-4-acetyl-1-benzyl-2-keto-5-(4-nitrophenyl)-3-pyrrolin-3-olate (5S)-4-acetyl-1-benzyl-2-keto-5-…
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) | 2.13 | 8.71 | -36.35 | 0 | 7 | -1 | 106 | 351.338 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 7.95 | -11.21 | 1 | 7 | 0 | 103 | 352.346 | 5 | ↓ |