In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 20 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[(1R)-1-(4-methoxyphenyl)propyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(1R)-1-(4-…
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) | 2.23 | 6.61 | -38.75 | 2 | 3 | 1 | 29 | 275.416 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 5.78 | -3.39 | 1 | 3 | 0 | 24 | 274.408 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 8.08 | -32.98 | 2 | 3 | 1 | 26 | 275.416 | 6 | ↓ |