In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 15 | Yes |
Popular Name: (2S)-1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]pyrrolidin-2-amine (2S)-1-[(2-methyl-1H-imidazol-5-…
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) | -0.60 | -1 | -41.36 | 4 | 6 | 1 | 94 | 231.301 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.60 | -1.41 | -13.12 | 3 | 6 | 0 | 92 | 230.293 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.60 | -0.97 | -107.73 | 5 | 6 | 2 | 95 | 232.309 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.