In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (1S,2S)-N2-[(1S)-1-cyclopropylethyl]-N1-ethyl-N2-methyl-indane-1,2-diamine (1S,2S)-N2-[(1S)-1-cyclopropylet…
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) | 3.27 | 9.46 | -113.32 | 3 | 2 | 2 | 21 | 260.425 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.27 | 6.42 | -1.24 | 1 | 2 | 0 | 15 | 258.409 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 8.64 | -32.24 | 2 | 2 | 1 | 16 | 259.417 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 7.29 | -35.15 | 2 | 2 | 1 | 20 | 259.417 | 5 | ↓ |