In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 25 | Yes |
Popular Name: 3-(2-imidazo[2,1-b]thiazol-6-ylacetyl)-12-methyl-3,8,12-triazaspiro[5.6]dodecan-7-one 3-(2-imidazo[2,1-b]thiazol-6-yla…
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) | 0.53 | 6.1 | -58.2 | 2 | 7 | 1 | 71 | 362.479 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.53 | 4.48 | -25.22 | 1 | 7 | 0 | 70 | 361.471 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.