In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 20 | No |
Popular Name: (5R)-4-acetyl-2-keto-1-methyl-5-(2-nitrophenyl)-3-pyrrolin-3-olate (5R)-4-acetyl-2-keto-1-methyl-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) | 0.69 | 5.21 | -53.61 | 0 | 7 | -1 | 106 | 275.24 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.69 | 4.28 | -11.87 | 1 | 7 | 0 | 103 | 276.248 | 3 | ↓ |