In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 20 | Yes |
Popular Name: 3-[(4-isopropylphenyl)methyl]-3,8-diazaspiro[4.5]decane 3-[(4-isopropylphenyl)methyl]-3,…
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) | 3.29 | 9.88 | -100.25 | 3 | 2 | 2 | 21 | 274.452 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 7.37 | -40.14 | 2 | 2 | 1 | 20 | 273.444 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.