In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 14 | Yes |
Popular Name: (3S)-1-[(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]pyrrolidin-3-amine (3S)-1-[(1R,8R)-2,3,5,6,7,8-hexa…
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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) | -0.12 | 4.44 | -194.68 | 5 | 3 | 3 | 37 | 198.334 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.12 | 0.47 | -43.75 | 3 | 3 | 1 | 34 | 196.318 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.12 | 2.98 | -88.42 | 4 | 3 | 2 | 35 | 197.326 | 1 | ↓ |