In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2010 | 11 | Yes |
Popular Name: 2-[(1-Methyl-pyrrolidin-2-ylmethyl)-amino]-ethanol 2-[(1-Methyl-pyrrolidin-2-ylmeth…
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CAS Numbers: 1026873-64-2 , 1354000-13-7
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) | -0.47 | 1.88 | -104.42 | 4 | 3 | 2 | 41 | 160.261 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.47 | 0.5 | -31.17 | 3 | 3 | 1 | 37 | 159.253 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.47 | -0.35 | -32.26 | 3 | 3 | 1 | 40 | 159.253 | 4 | ↓ |