In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2009 | 22 | Yes |
Popular Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-4-imidazol-1-yl-benzamide N-[[(2S)-1-ethylpyrrolidin-2-yl]…
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) | 1.26 | 8.71 | -45.44 | 2 | 5 | 1 | 51 | 299.398 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.26 | 6.37 | -12.05 | 1 | 5 | 0 | 50 | 298.39 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 9.21 | -82.28 | 3 | 5 | 2 | 53 | 300.406 | 5 | ↓ |