In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 17 | Yes |
Popular Name: (1S,2R,5S)-2-isopropyl-5-methyl-1-(propylamino)cyclohexanecarboxamide (1S,2R,5S)-2-isopropyl-5-methyl-…
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) | 3.43 | 4.54 | -43.15 | 4 | 3 | 1 | 60 | 241.399 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.43 | 4.91 | -4.36 | 3 | 3 | 0 | 55 | 240.391 | 5 | ↓ |