In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 23 | Yes |
Popular Name: (6S)-4-[(4-imidazol-1-ylphenyl)methyl]-4,8-diazaspiro[5.5]undecane (6S)-4-[(4-imidazol-1-ylphenyl)m…
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) | 1.38 | 9.23 | -44.72 | 2 | 4 | 1 | 38 | 311.453 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 9.69 | -48.08 | 2 | 4 | 1 | 34 | 311.453 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.38 | 11.34 | -168.03 | 4 | 4 | 3 | 40 | 313.469 | 3 | ↓ |