In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2006 | 22 | No |
Popular Name: 4-acetyl-1-(2-dimethylaminoethyl)-3-hydroxy-5-(4-hydroxyphenyl)-5H-pyrrol-2-one 4-acetyl-1-(2-dimethylaminoethyl…
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) | 0.33 | -0.76 | -53.23 | 3 | 6 | 1 | 82 | 305.354 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.33 | -1.04 | -58.88 | 3 | 6 | 1 | 82 | 305.354 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.26 | -0.99 | -67.45 | 2 | 6 | 1 | 79 | 305.354 | 5 | ↓ |