In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 31 | No |
Popular Name: (2R)-1-butyl-3-(3-ethoxybenzoyl)-4-hydroxy-2-(3-nitrophenyl)-2H-pyrrol-5-one (2R)-1-butyl-3-(3-ethoxybenzoyl)…
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) | 4.16 | 10.9 | -55.38 | 0 | 8 | -1 | 115 | 423.445 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.16 | 10.14 | -16.17 | 1 | 8 | 0 | 113 | 424.453 | 9 | ↓ |