In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 20 | Yes |
Popular Name: (5S)-3-[(E)-2-methyl-3-phenyl-allyl]-3,7-diazaspiro[4.5]decane (5S)-3-[(E)-2-methyl-3-phenyl-al…
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) | 3.28 | 7.4 | -38.86 | 2 | 2 | 1 | 20 | 271.428 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 9.92 | -107.98 | 3 | 2 | 2 | 21 | 272.436 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.