In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: (3S)-N-[(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-1-cyclopropyl-pyrrolidin-3-amine (3S)-N-[(1S)-1-(5-bromobenzofura…
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) | 3.92 | 8.9 | -34.86 | 2 | 3 | 1 | 30 | 350.28 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.92 | 9.94 | -113.57 | 3 | 3 | 2 | 34 | 351.288 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.92 | 7.53 | -40.99 | 2 | 3 | 1 | 33 | 350.28 | 4 | ↓ |