In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 27 | No |
Popular Name: (5R)-4-(4-chlorobenzoyl)-1-(2-dimethylaminoethyl)-3-hydroxy-5-(2-pyridyl)-5H-pyrrol-2-one (5R)-4-(4-chlorobenzoyl)-1-(2-di…
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) | 1.92 | 8.63 | -71.77 | 1 | 6 | 0 | 78 | 385.851 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.92 | 6.09 | -57.28 | 0 | 6 | -1 | 77 | 384.843 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 7.8 | -51.5 | 2 | 6 | 1 | 75 | 386.859 | 6 | ↓ |