In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 29 | No |
Popular Name: (2S)-3-(4-chlorobenzoyl)-4-hydroxy-1-(3-hydroxypropyl)-2-(2-nitrophenyl)-2H-pyrrol-5-one (2S)-3-(4-chlorobenzoyl)-4-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) | 2.61 | 6.96 | -55.05 | 1 | 8 | -1 | 126 | 415.809 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.61 | 6.18 | -15.13 | 2 | 8 | 0 | 124 | 416.817 | 7 | ↓ |