In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 22nd, 2007 | 33 | No |
Popular Name: 3-hydroxy-4-(4-methylbenzoyl)-1-(2-morpholinoethyl)-5-(3-nitrophenyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-methylbenzoyl)-1-…
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) | 2.64 | 9.85 | -59.12 | 2 | 9 | 1 | 117 | 452.487 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.05 | -0.16 | -70.06 | 1 | 9 | 1 | 113 | 452.487 | 7 | ↓ |