In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 19 | Yes |
Popular Name: (2S)-2-[5-(3,4-dimethylphenyl)-1H-imidazol-2-yl]piperidine (2S)-2-[5-(3,4-dimethylphenyl)-1…
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) | 3.18 | 7.65 | -36.45 | 3 | 3 | 1 | 45 | 256.373 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 6.62 | -7.86 | 2 | 3 | 0 | 41 | 255.365 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.18 | 8.14 | -109.04 | 4 | 3 | 2 | 47 | 257.381 | 2 | ↓ |