In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 29 | Yes |
Popular Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-1-isopropyl-2-oxo-1,8-naphthyridine-3-carboxamide N-[(3S)-1-benzylpyrrolidin-3-yl]…
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) | 2.49 | 11.22 | -40.13 | 2 | 6 | 1 | 68 | 391.495 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 10.15 | -56.56 | 1 | 6 | 0 | 75 | 390.487 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.