In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[(1R)-1-(3-methylbenzofuran-2-yl)ethyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(1R)-1-(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) | 3.51 | 8.78 | -36.05 | 2 | 3 | 1 | 30 | 285.411 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 7.56 | -39.46 | 2 | 3 | 1 | 33 | 285.411 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 10 | -106.73 | 3 | 3 | 2 | 34 | 286.419 | 4 | ↓ |