In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 17 | Yes |
Popular Name: N-[(5-chloro-1-methyl-imidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine N-[(5-chloro-1-methyl-imidazol-2…
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) | 0.61 | 2.55 | -8.59 | 1 | 5 | 0 | 56 | 251.721 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.61 | 3.01 | -34.29 | 2 | 5 | 1 | 57 | 252.729 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.61 | 3.93 | -48.41 | 2 | 5 | 1 | 60 | 252.729 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.