In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 20 | Yes |
Popular Name: (1S,2R,4S)-N-[(6-methoxyimidazo[2,1-b]thiazol-5-yl)methyl]-2,4-dimethyl-cyclohexanamine (1S,2R,4S)-N-[(6-methoxyimidazo[…
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) | 3.17 | 6.58 | -41.99 | 2 | 4 | 1 | 43 | 294.444 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.17 | 5.55 | -7.8 | 1 | 4 | 0 | 39 | 293.436 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.