In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 17 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[(3-fluorophenyl)methyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(3-fluorop…
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) | 2.15 | 7.14 | -33.82 | 2 | 2 | 1 | 16 | 235.326 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.15 | 5.97 | -44.07 | 2 | 2 | 1 | 20 | 235.326 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.15 | 4.79 | -3.39 | 1 | 2 | 0 | 15 | 234.318 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 8.31 | -116.17 | 3 | 2 | 2 | 21 | 236.334 | 4 | ↓ |