In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 16 | No |
Popular Name: (1-aminocyclopentyl)-[(2S,6S)-2,6-dimethylthiomorpholin-4-yl]methanone (1-aminocyclopentyl)-[(2S,6S)-2,…
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) | 1.66 | 4.99 | -48.8 | 3 | 3 | 1 | 48 | 243.396 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.66 | 4.77 | -5.7 | 2 | 3 | 0 | 46 | 242.388 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.