In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 17 | Yes |
Popular Name: (1S)-1-(2,4-dimethylthiazol-5-yl)-N-[[(3S)-3-methylpyrrolidin-3-yl]methyl]ethanamine (1S)-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) | 1.69 | 3.87 | -41.62 | 3 | 3 | 1 | 42 | 254.423 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.69 | 5 | -107.3 | 4 | 3 | 2 | 46 | 255.431 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.