In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2010 | 20 | Yes |
Popular Name: 2-cyano-2-methyl-N-[(2S)-3-methyl-2-(4-methyl-1-piperidyl)butyl]propanamide 2-cyano-2-methyl-N-[(2S)-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) | 2.98 | 8.32 | -51.55 | 2 | 4 | 1 | 57 | 280.436 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 6.65 | -35.07 | 1 | 4 | 0 | 64 | 279.428 | 5 | ↓ |