In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 24th, 2011 | 21 | Yes |
Popular Name: N,N-diethyl-4-[(2S)-5-methyl-2H-benzimidazol-2-yl]aniline N,N-diethyl-4-[(2S)-5-methyl-2H-…
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) | 4.64 | 8.98 | -16.88 | 3 | 3 | 0 | 32 | 282.411 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.64 | 8.89 | -97.47 | 2 | 3 | 2 | 31 | 281.403 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.