In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 9th, 2010 | 35 | No |
Popular Name: (2S)-3-(4-butoxybenzoyl)-2-(4-chlorophenyl)-4-hydroxy-1-(2-morpholinoethyl)-2H-pyrrol-5-one (2S)-3-(4-butoxybenzoyl)-2-(4-ch…
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) | 4.43 | 8.84 | -56.15 | 0 | 7 | -1 | 82 | 497.999 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 11.1 | -66.2 | 1 | 7 | 0 | 83 | 499.007 | 10 | ↓ |
Lo Low (pH 4.5-6) | 4.43 | 10.36 | -49.93 | 2 | 7 | 1 | 81 | 500.015 | 10 | ↓ |