In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 30 | Yes |
Popular Name: (4S)-2-(3-chlorobenzoyl)-N-[(1R)-1-(4-pyridyl)ethyl]-2,8-diazaspiro[4.5]decane-4-carboxamide (4S)-2-(3-chlorobenzoyl)-N-[(1R)…
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) | 1.47 | 7.38 | -63.21 | 3 | 6 | 1 | 79 | 427.956 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 7.84 | -118.79 | 4 | 6 | 2 | 80 | 428.964 | 4 | ↓ |