In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 26 | No |
Popular Name: 1-allyl-4-(4-bromobenzoyl)-5-(4-bromophenyl)-3-hydroxy-5H-pyrrol-2-one 1-allyl-4-(4-bromobenzoyl)-5-(4-…
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) | 4.64 | 9.98 | -53.12 | 0 | 4 | -1 | 60 | 476.144 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.06 | 9.92 | -18.77 | 0 | 4 | 0 | 54 | 477.152 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.09 | 8.9 | -26.63 | 1 | 4 | 0 | 58 | 477.152 | 4 | ↓ |