In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 19 | Yes |
Popular Name: (2S)-N-[(1-allylcyclohexyl)methyl]-2-amino-butanediamide (2S)-N-[(1-allylcyclohexyl)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) | 1.41 | 0.47 | -39.72 | 6 | 5 | 1 | 100 | 268.381 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 0.11 | -10.88 | 5 | 5 | 0 | 98 | 267.373 | 7 | ↓ |