In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 15 | No |
Popular Name: 4-[(3S)-3-(chloromethyl)pyrrolidin-1-yl]sulfonyl-1H-imidazole 4-[(3S)-3-(chloromethyl)pyrrolid…
None
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) | 0.64 | 2.2 | -12.82 | 1 | 5 | 0 | 66 | 249.723 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.64 | 1.71 | -38.57 | 0 | 5 | -1 | 64 | 248.715 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.