In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 37 | No |
Popular Name: (2S)-3-(4-butoxybenzoyl)-1-[3-(dibutylamino)propyl]-4-hydroxy-2-(2-thienyl)-2H-pyrrol-5-one (2S)-3-(4-butoxybenzoyl)-1-[3-(d…
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) | 6.95 | 15.59 | -73.56 | 1 | 6 | 0 | 74 | 526.743 | 17 | ↓ |
Lo Low (pH 4.5-6) | 6.95 | 14.83 | -51.05 | 2 | 6 | 1 | 71 | 527.751 | 17 | ↓ |