In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 17 | No |
Popular Name: (3S)-1-[(1R)-1-[4-(chloromethyl)thiazol-2-yl]ethyl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[(1R)-1-[4-(chloromethyl)…
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) | 1.93 | 5.21 | -38.69 | 1 | 3 | 1 | 21 | 274.841 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 2.82 | -4.65 | 0 | 3 | 0 | 19 | 273.833 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.