In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 32 | Yes |
Popular Name: (3S)-4-benzoyl-8-propanoyl-N-(3-pyridylmethyl)-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide (3S)-4-benzoyl-8-propanoyl-N-(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) | 0.68 | 5.84 | -21.12 | 1 | 8 | 0 | 92 | 436.512 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.68 | 6.31 | -61.63 | 2 | 8 | 1 | 93 | 437.52 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.