In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | Yes |
Popular Name: [1-[(5-chloro-1-methyl-imidazol-2-yl)methyl]-3,5-dimethyl-pyrazol-4-yl]methanamine [1-[(5-chloro-1-methyl-imidazol-…
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) | 0.50 | 3.89 | -45.49 | 3 | 5 | 1 | 63 | 254.745 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.50 | 3.49 | -7.08 | 2 | 5 | 0 | 62 | 253.737 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.