In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 32 | No |
Popular Name: 1-(2-diethylaminoethyl)-3-hydroxy-4-(4-methylbenzoyl)-5-(2-nitrophenyl)-5H-pyrrol-2-one 1-(2-diethylaminoethyl)-3-hydrox…
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) | 3.52 | 11.65 | -49.83 | 2 | 8 | 1 | 108 | 438.504 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.94 | 2.04 | -54.1 | 1 | 8 | 1 | 104 | 438.504 | 9 | ↓ |