In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (2S)-2-[[(1R)-cyclohex-3-en-1-yl]methylamino]-1-(1-piperidyl)propan-1-one (2S)-2-[[(1R)-cyclohex-3-en-1-yl…
None
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) | 2.49 | 7.47 | -41.23 | 2 | 3 | 1 | 37 | 251.394 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.49 | 6.32 | -6.83 | 1 | 3 | 0 | 32 | 250.386 | 4 | ↓ |