In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 28 | Yes |
Popular Name: [(3S,4S)-3-amino-4-ethyl-3-methyl-pyrrolidin-1-yl]-fluoro-methyl-oxo-BLAHcarboxylic [(3S,4S)-3-amino-4-ethyl-3-methy…
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) | 0.80 | 8.56 | -102.24 | 3 | 7 | 0 | 102 | 389.427 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.80 | 6.55 | -59.72 | 4 | 7 | 1 | 99 | 390.435 | 3 | ↓ |
Lo Low (pH 4.5-6) | -1.94 | 6.72 | -85.66 | 4 | 7 | 1 | 105 | 390.435 | 2 | ↓ |