In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | Yes |
Popular Name: N,N-diisopropyl-N'-[(4S)-thiochroman-4-yl]ethane-1,2-diamine N,N-diisopropyl-N'-[(4S)-thiochr…
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) | 2.67 | 9.9 | -123.4 | 3 | 2 | 2 | 21 | 294.508 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 8.12 | -32.9 | 2 | 2 | 1 | 16 | 293.5 | 6 | ↓ |