In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 19 | Yes |
Popular Name: [2-(azocan-1-yl)-4-tert-butyl-thiazol-5-yl]methanamine [2-(azocan-1-yl)-4-tert-butyl-th…
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) | 4.38 | 7.33 | -44.31 | 3 | 3 | 1 | 44 | 282.477 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.38 | 7.01 | -5.21 | 2 | 3 | 0 | 42 | 281.469 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.