In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 27 | No |
Popular Name: 5-(3-bromophenyl)-3-hydroxy-1-(2-methoxyethyl)-4-(4-methylbenzoyl)-5H-pyrrol-2-one 5-(3-bromophenyl)-3-hydroxy-1-(2…
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) | 3.60 | 8.48 | -60.06 | 0 | 5 | -1 | 70 | 429.29 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.04 | 7.37 | -30.75 | 1 | 5 | 0 | 67 | 430.298 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.01 | -1 | -25.91 | 0 | 5 | 0 | 63 | 430.298 | 6 | ↓ |