In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 23 | Yes |
Popular Name: N-[3-[(2S)-5-fluoro-2H-benzimidazol-2-yl]propyl]-1-propyl-piperidin-4-amine N-[3-[(2S)-5-fluoro-2H-benzimida…
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) | 3.53 | 7.89 | -292.2 | 5 | 4 | 4 | 49 | 322.472 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 5.67 | -200.75 | 4 | 4 | 3 | 48 | 321.464 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 6.71 | -162.63 | 4 | 4 | 3 | 44 | 321.464 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.