In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2010 | 14 | Yes |
Popular Name: (3S)-N-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidin-3-amine (3S)-N-methyl-1-[(3-methyl-1,2,4…
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) | -0.27 | 0.96 | -40.3 | 2 | 5 | 1 | 55 | 197.262 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.27 | -0.36 | -47.1 | 2 | 5 | 1 | 59 | 197.262 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.27 | 2.17 | -117.79 | 3 | 5 | 2 | 60 | 198.27 | 3 | ↓ |