In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 26 | Yes |
Popular Name: 5-[(1R,2R)-2-[[benzyl(methyl)amino]methyl]cyclopentyl]-1H-indole-3-carbonitrile 5-[(1R,2R)-2-[[benzyl(methyl)ami…
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) | 4.97 | 13.67 | -42.97 | 2 | 3 | 1 | 44 | 344.482 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.97 | 11.46 | -10.07 | 1 | 3 | 0 | 43 | 343.474 | 5 | ↓ |