In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 30 | No |
Popular Name: (2R)-2-(3-allyloxyphenyl)-3-(4-bromobenzoyl)-4-hydroxy-1-(3-hydroxypropyl)-2H-pyrrol-5-one (2R)-2-(3-allyloxyphenyl)-3-(4-b…
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) | 3.50 | 6.95 | -57.22 | 1 | 6 | -1 | 90 | 471.327 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.50 | 6.19 | -14.03 | 2 | 6 | 0 | 87 | 472.335 | 9 | ↓ |