In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 20 | Yes |
Popular Name: 4-methyl-5-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]sulfonyl-3H-thiazol-2-one 4-methyl-5-[(3S)-3-pyrrolidin-1-…
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) | 0.69 | 2.56 | -45.7 | 2 | 6 | 1 | 75 | 318.444 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.69 | 0.16 | -10.61 | 1 | 6 | 0 | 73 | 317.436 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.