In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 16 | Yes |
Popular Name: (3R)-1-(1H-imidazol-4-ylsulfonyl)-N,N-dimethyl-pyrrolidin-3-amine (3R)-1-(1H-imidazol-4-ylsulfonyl…
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) | -0.32 | 2.12 | -48.06 | 2 | 6 | 1 | 70 | 245.328 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.32 | -0.28 | -14.78 | 1 | 6 | 0 | 69 | 244.32 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.