In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: (1S)-N'-[(1R)-indan-1-yl]-N,N-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N'-[(1R)-indan-1-yl]-N,N-di…
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) | 3.56 | 9.99 | -36.22 | 2 | 2 | 1 | 16 | 281.423 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.56 | 7.62 | -2.33 | 1 | 2 | 0 | 15 | 280.415 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 8.78 | -37.97 | 2 | 2 | 1 | 20 | 281.423 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 11.2 | -124.48 | 3 | 2 | 2 | 21 | 282.431 | 5 | ↓ |