In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 18 | Yes |
Popular Name: (1S,5R,6S)-N-[3-(4-methyl-1-piperidyl)propyl]bicyclo[3.2.0]hept-3-en-6-amine (1S,5R,6S)-N-[3-(4-methyl-1-pipe…
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) | 3.06 | 9.71 | -105.11 | 3 | 2 | 2 | 21 | 250.43 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 7.47 | -37.66 | 2 | 2 | 1 | 20 | 249.422 | 5 | ↓ |