In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 20 | No |
Popular Name: (E)-3-[5-[(2S)-2-carbamoylpyrrolidin-1-yl]-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic (E)-3-[5-[(2S)-2-carbamoylpyrrol…
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) | 0.24 | 1.36 | -52.57 | 2 | 7 | -1 | 104 | 277.304 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.24 | 1.45 | -54.15 | 3 | 7 | 0 | 106 | 278.312 | 4 | ↓ |