In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: N',N'-diisopropyl-N-[(1S)-3-methyl-1-phenyl-butyl]ethane-1,2-diamine N',N'-diisopropyl-N-[(1S)-3-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) | 3.81 | 9.09 | -40.72 | 2 | 2 | 1 | 20 | 291.503 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.81 | 9.94 | -31.22 | 2 | 2 | 1 | 16 | 291.503 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 11.16 | -118.42 | 3 | 2 | 2 | 21 | 292.511 | 9 | ↓ |