In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 20 | Yes |
Popular Name: N-[[2-(azocan-1-yl)-4-ethyl-thiazol-5-yl]methyl]cyclopropanamine N-[[2-(azocan-1-yl)-4-ethyl-thia…
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) | 3.97 | 9.57 | -36.03 | 2 | 3 | 1 | 33 | 294.488 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.97 | 8.29 | -5.54 | 1 | 3 | 0 | 28 | 293.48 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.