In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: N-[(4S)-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl]-1,3,5-trimethyl-pyrazol-4-amine N-[(4S)-1,1-dioxo-3,4-dihydro-2H…
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) | 1.59 | 3.87 | -16.38 | 1 | 5 | 0 | 64 | 305.403 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 3.99 | -45.05 | 2 | 5 | 1 | 65 | 306.411 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.