In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 13 | No |
Popular Name: (1S,2R)-2-[(3R)-3-methylthiomorpholin-4-yl]cyclopentanol (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) | 1.31 | 4.39 | -28.95 | 2 | 2 | 1 | 25 | 202.343 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 2.62 | -3.17 | 1 | 2 | 0 | 23 | 201.335 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.