In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(1S)-1-(2,…
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) | 2.08 | 5.64 | -42.71 | 2 | 4 | 1 | 38 | 289.399 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.08 | 8.05 | -115.11 | 3 | 4 | 2 | 40 | 290.407 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.08 | 7.12 | -35.1 | 2 | 4 | 1 | 35 | 289.399 | 4 | ↓ |