In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 21 | Yes |
Popular Name: (4R,5R)-4-amino-1-(2-methoxyethyl)-5-(1-methylindolin-5-yl)pyrrolidin-2-one (4R,5R)-4-amino-1-(2-methoxyethy…
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) | 0.30 | 4.52 | -56.09 | 3 | 5 | 1 | 60 | 290.387 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.30 | 4.21 | -9.99 | 2 | 5 | 0 | 59 | 289.379 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.