In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 17 | Yes |
Popular Name: 5-[(1R)-1-aminoethyl]-N-(3-furylmethyl)-N,4-dimethyl-thiazol-2-amine 5-[(1R)-1-aminoethyl]-N-(3-furyl…
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 | 4.67 | -45.42 | 3 | 4 | 1 | 57 | 252.363 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.24 | 4.32 | -8.37 | 2 | 4 | 0 | 55 | 251.355 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.