In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 19 | Yes |
Popular Name: 4-[(1R)-1-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]ethyl]benzonitrile 4-[(1R)-1-[[(3R)-1-cyclopropylpy…
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) | 2.33 | 8.26 | -38.94 | 2 | 3 | 1 | 40 | 256.373 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 5.91 | -5.1 | 1 | 3 | 0 | 39 | 255.365 | 4 | ↓ |