In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 22 | No |
Popular Name: 1-(thiazol-4-ylmethyl)-3-[(1-thiomorpholinocyclopentyl)methyl]urea 1-(thiazol-4-ylmethyl)-3-[(1-thi…
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) | 2.20 | 5.25 | -41.47 | 3 | 5 | 1 | 58 | 341.526 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.20 | 3.41 | -9.34 | 2 | 5 | 0 | 57 | 340.518 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.