In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2010 | 18 | Yes |
Popular Name: N-tert-butyl-N'-[(1R,2S)-2-phenylcyclopropyl]propane-1,3-diamine N-tert-butyl-N'-[(1R,2S)-2-pheny…
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) | 3.04 | 8.35 | -106.43 | 4 | 2 | 2 | 33 | 248.414 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 7.11 | -39.48 | 3 | 2 | 1 | 29 | 247.406 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 7.05 | -35.09 | 3 | 2 | 1 | 29 | 247.406 | 7 | ↓ |