In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2011 | 20 | Yes |
Popular Name: (5S)-N-isobutyl-5-phenyl-4,5,6,7-tetrahydro-2H-indazol-3-amine (5S)-N-isobutyl-5-phenyl-4,5,6,7…
None
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) | 4.15 | 9.07 | -28.95 | 3 | 3 | 1 | 42 | 270.4 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.15 | 8.97 | -6.12 | 2 | 3 | 0 | 41 | 269.392 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.