In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 20 | Yes |
Popular Name: (4S)-1-methyl-N-[(1R)-1-(2-thienyl)butyl]-4,5,6,7-tetrahydroindazol-4-amine (4S)-1-methyl-N-[(1R)-1-(2-thien…
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) | 2.89 | 8.21 | -35.6 | 2 | 3 | 1 | 34 | 290.456 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.89 | 7.28 | -7.66 | 1 | 3 | 0 | 30 | 289.448 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.