In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: N-[[(1S)-cyclohex-3-en-1-yl]methyl]-1-(3-methylbut-2-enyl)piperidin-4-amine N-[[(1S)-cyclohex-3-en-1-yl]meth…
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) | 3.99 | 8.13 | -39.92 | 2 | 2 | 1 | 20 | 263.449 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 9.21 | -32.87 | 2 | 2 | 1 | 16 | 263.449 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.99 | 10.39 | -108.47 | 3 | 2 | 2 | 21 | 264.457 | 5 | ↓ |