| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 21 | Yes |
Popular Name: (3S)-3-[[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]-3-(2-thienyl)propanoic (3S)-3-[[(4S)-1-methyl-4,5,6,7-t…
| 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) | 0.97 | 7.57 | -32.99 | 2 | 5 | 0 | 75 | 305.403 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 6.45 | -50.88 | 1 | 5 | -1 | 70 | 304.395 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.97 | 7.73 | -63.6 | 3 | 5 | 1 | 76 | 306.411 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
