In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 20 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[(3-isopropoxyphenyl)methyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(3-isoprop…
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) | 2.78 | 6.75 | -40.74 | 2 | 3 | 1 | 29 | 275.416 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.78 | 5.57 | -3.48 | 1 | 3 | 0 | 24 | 274.408 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.78 | 7.92 | -32.67 | 2 | 3 | 1 | 26 | 275.416 | 6 | ↓ |