In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 24 | Yes |
Popular Name: N-[[(3R)-1-isopropylpyrrolidin-3-yl]methyl]-2,3-dimethyl-quinoxaline-6-carboxamide N-[[(3R)-1-isopropylpyrrolidin-3…
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) | 2.55 | 6.77 | -47.21 | 2 | 5 | 1 | 59 | 327.452 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 5.44 | -103.16 | 3 | 5 | 2 | 64 | 328.46 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.