In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2011 | 18 | Yes |
Popular Name: (4S)-1-(4-methoxyphenyl)-4,5,6,7-tetrahydroindazol-4-amine (4S)-1-(4-methoxyphenyl)-4,5,6,7…
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) | -0.04 | 4.47 | -49.12 | 3 | 4 | 1 | 55 | 244.318 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.04 | 4.16 | -7.27 | 2 | 4 | 0 | 53 | 243.31 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.