| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 19 | Yes |
Popular Name: (4S)-N-[(1S)-1-(3-bromo-2-thienyl)ethyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (4S)-N-[(1S)-1-(3-bromo-2-thieny…
| 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) | 2.57 | 7.57 | -36.71 | 2 | 3 | 1 | 34 | 341.298 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.57 | 6.57 | -6.21 | 1 | 3 | 0 | 30 | 340.29 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.57 | 7.73 | -97.06 | 3 | 3 | 2 | 36 | 342.306 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
