In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 14 | Yes |
Popular Name: (3S)-1-isopropyl-N-[(1S)-2-methoxy-1-methyl-ethyl]pyrrolidin-3-amine (3S)-1-isopropyl-N-[(1S)-2-metho…
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) | 1.23 | 3.68 | -30.53 | 2 | 3 | 1 | 26 | 201.334 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.23 | 1.29 | -2.12 | 1 | 3 | 0 | 24 | 200.326 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.23 | 2.35 | -33.47 | 2 | 3 | 1 | 29 | 201.334 | 5 | ↓ |