In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 17 | Yes |
Popular Name: (1R)-1-[2-[(2S)-2-ethylpyrrolidin-1-yl]-4-methyl-thiazol-5-yl]-N-methyl-ethanamine (1R)-1-[2-[(2S)-2-ethylpyrrolidi…
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) | 2.94 | 7.09 | -38.45 | 2 | 3 | 1 | 33 | 254.423 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 5.84 | -6.56 | 1 | 3 | 0 | 28 | 253.415 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.