In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 24 | Yes |
Popular Name: 4-cyano-N-(2-dimethylaminoethyl)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]benzamide 4-cyano-N-(2-dimethylaminoethyl)…
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) | 1.49 | 10.7 | -118.59 | 2 | 5 | 2 | 53 | 330.476 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.49 | 8.82 | -43.49 | 1 | 5 | 1 | 52 | 329.468 | 7 | ↓ |