In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 21 | Yes |
Popular Name: N-ethyl-N-[4-[[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]methyl]thiazol-2-yl]acetamide N-ethyl-N-[4-[[[(2S)-1-ethylpyrr…
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) | 1.43 | 7.06 | -33.85 | 2 | 5 | 1 | 50 | 311.475 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 5.22 | -14.1 | 1 | 5 | 0 | 48 | 310.467 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 6.56 | -40.59 | 2 | 5 | 1 | 53 | 311.475 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 8.4 | -108.2 | 3 | 5 | 2 | 54 | 312.483 | 7 | ↓ |