In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 15 | Yes |
Popular Name: 5-[(1R)-1-aminoethyl]-N-(cyclobutylmethyl)-N-methyl-thiazol-2-amine 5-[(1R)-1-aminoethyl]-N-(cyclobu…
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) | 0.24 | 5.24 | -42.53 | 3 | 3 | 1 | 44 | 226.369 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.24 | 4.92 | -5.15 | 2 | 3 | 0 | 42 | 225.361 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.