In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 17 | Yes |
Popular Name: N-isopropyl-N'-[(1S,2S)-2-phenylcyclopropyl]propane-1,3-diamine N-isopropyl-N'-[(1S,2S)-2-phenyl…
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) | 2.53 | 8.23 | -101.45 | 4 | 2 | 2 | 33 | 234.387 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 7.01 | -35.5 | 3 | 2 | 1 | 29 | 233.379 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 7.09 | -36.1 | 3 | 2 | 1 | 29 | 233.379 | 7 | ↓ |