In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 18 | Yes |
Popular Name: (1R)-N-ethyl-1-[2-[(2S)-2-ethylpyrrolidin-1-yl]-4-methyl-thiazol-5-yl]ethanamine (1R)-N-ethyl-1-[2-[(2S)-2-ethylp…
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) | 3.32 | 7.94 | -37.11 | 2 | 3 | 1 | 33 | 268.45 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.32 | 6.76 | -6.35 | 1 | 3 | 0 | 28 | 267.442 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.