In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 20 | No |
Popular Name: (4S)-6-chloro-N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]thiochroman-4-amine (4S)-6-chloro-N-[(3S)-3-methyl-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) | 1.92 | 5.14 | -57.65 | 2 | 3 | 1 | 51 | 332.898 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.92 | 4.28 | -13.23 | 1 | 3 | 0 | 46 | 331.89 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.