In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 19 | Yes |
Popular Name: (1R,2S,4R)-2,4-dimethyl-N-[(6-methylimidazo[2,1-b]thiazol-5-yl)methyl]cyclohexanamine (1R,2S,4R)-2,4-dimethyl-N-[(6-me…
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) | 3.21 | 8.98 | -47.41 | 2 | 3 | 1 | 34 | 278.445 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 7.94 | -8.04 | 1 | 3 | 0 | 29 | 277.437 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.