In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | No |
Popular Name: (1S,2R)-2-[(3R)-3-methylthiomorpholine-4-carbonyl]cyclopropanecarboxylic (1S,2R)-2-[(3R)-3-methylthiomorp…
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) | 0.73 | 6.26 | -50.02 | 0 | 4 | -1 | 60 | 228.293 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.73 | 4.53 | -12.08 | 1 | 4 | 0 | 58 | 229.301 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.