In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 29 | Yes |
Popular Name: (3S)-4-(4-methylbenzoyl)-N-(4-pyridylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide (3S)-4-(4-methylbenzoyl)-N-(4-py…
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) | 2.37 | 6.35 | -12.91 | 1 | 6 | 0 | 72 | 393.487 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.37 | 6.81 | -52.86 | 2 | 6 | 1 | 73 | 394.495 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.