In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: 4-[[(4R)-6-chlorothiochroman-4-yl]amino]piperidine-1-carboxamide 4-[[(4R)-6-chlorothiochroman-4-y…
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) | 1.65 | 5.79 | -53.9 | 4 | 4 | 1 | 63 | 326.873 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.65 | 5.09 | -11.23 | 3 | 4 | 0 | 58 | 325.865 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.