In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 30 | No |
Popular Name: (5S)-4-(4-fluorobenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(2-thienyl)-5H-pyrrol-2-one (5S)-4-(4-fluorobenzoyl)-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) | 2.59 | 6.37 | -55.9 | 0 | 6 | -1 | 73 | 429.493 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 8.7 | -68.53 | 1 | 6 | 0 | 74 | 430.501 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.59 | 7.88 | -48.11 | 2 | 6 | 1 | 71 | 431.509 | 7 | ↓ |