In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: (2S)-2-amino-N-[(1S,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]-3-phenyl-propanamide (2S)-2-amino-N-[(1S,8R)-2,3,5,6,…
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) | 0.63 | 5.07 | -95.59 | 5 | 4 | 2 | 61 | 275.396 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.62 | 2.26 | -6.43 | 3 | 4 | 0 | 58 | 273.38 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.63 | 4.77 | -40.97 | 4 | 4 | 1 | 60 | 274.388 | 4 | ↓ |