In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 15 | Yes |
Popular Name: (S)-1-(2-Methoxybenzyl)pyrrolidin-3-amine dihydrochloride (S)-1-(2-Methoxybenzyl)pyrrolidi…
Find On: PubMed — Wikipedia — Google
CAS Number: 169452-17-9
None
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) | 0.75 | 3.91 | -31.13 | 3 | 3 | 1 | 40 | 207.297 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.74 | 1.81 | -42.84 | 3 | 3 | 1 | 40 | 207.297 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.75 | 4.22 | -111.32 | 4 | 3 | 2 | 41 | 208.305 | 3 | ↓ |