| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2010 | 11 | Yes |
Popular Name: (1-Methyl-pyrrolidin-3-ylamino)-acetic acid (1-Methyl-pyrrolidin-3-ylamino)-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1249211-32-2 , 1354002-74-6
| 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) | -1.42 | 2.74 | -57.45 | 2 | 4 | 0 | 57 | 158.201 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.42 | 0.2 | -43.02 | 1 | 4 | -1 | 55 | 157.193 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.42 | 1.33 | -33.02 | 2 | 4 | 0 | 60 | 158.201 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.42 | 3.89 | -83.79 | 3 | 4 | 1 | 61 | 159.209 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.