In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 26 | No |
Popular Name: (2S)-4-hydroxy-1-(3-hydroxypropyl)-3-(4-methoxybenzoyl)-2-(2-thienyl)-2H-pyrrol-5-one (2S)-4-hydroxy-1-(3-hydroxypropy…
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) | 1.97 | 3.99 | -59.49 | 1 | 6 | -1 | 90 | 372.422 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.97 | 3.24 | -14.3 | 2 | 6 | 0 | 87 | 373.43 | 7 | ↓ |