In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 29 | No |
Popular Name: (5S)-4-benzoyl-5-(2,4-dichlorophenyl)-1-(3-dimethylaminopropyl)-3-hydroxy-5H-pyrrol-2-one (5S)-4-benzoyl-5-(2,4-dichloroph…
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) | 3.96 | 11.38 | -69.72 | 1 | 5 | 0 | 65 | 433.335 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.41 | 10.24 | -54.92 | 2 | 5 | 1 | 62 | 434.343 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 11.28 | -51.94 | 1 | 5 | 1 | 59 | 434.343 | 7 | ↓ |