In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2008 | 24 | Yes |
Popular Name: (5S)-7-(cyclohexylmethyl)-3-(3-pyridylmethyl)-3,7-diazaspiro[4.5]decane (5S)-7-(cyclohexylmethyl)-3-(3-p…
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) | 3.43 | 12.36 | -111.12 | 2 | 3 | 2 | 22 | 329.532 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.43 | 12.64 | -187.02 | 3 | 3 | 3 | 23 | 330.54 | 4 | ↓ |