In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 16 | Yes |
Popular Name: (1R)-1-(2,4-dimethylthiazol-5-yl)-N-(2-furylmethyl)ethanamine (1R)-1-(2,4-dimethylthiazol-5-yl…
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) | 1.82 | 5.42 | -42.15 | 2 | 3 | 1 | 43 | 237.348 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.82 | 4.21 | -7.22 | 1 | 3 | 0 | 38 | 236.34 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.