In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 20 | Yes |
Popular Name: (4R,5R)-4-amino-5-(2-methoxy-1-naphthyl)-1-methyl-pyrrolidin-2-one (4R,5R)-4-amino-5-(2-methoxy-1-n…
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) | 1.41 | 5.53 | -49.74 | 3 | 4 | 1 | 57 | 271.34 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 5.24 | -8.49 | 2 | 4 | 0 | 56 | 270.332 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.