| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 19 | Yes |
Popular Name: (1R,2S)-N2-(cyclopropylmethyl)-N1,N2-diethyl-indane-1,2-diamine (1R,2S)-N2-(cyclopropylmethyl)-N…
| 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) | 3.31 | 9.96 | -33.4 | 2 | 2 | 1 | 16 | 259.417 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.31 | 7.81 | -1.9 | 1 | 2 | 0 | 15 | 258.409 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 10.71 | -111.12 | 3 | 2 | 2 | 21 | 260.425 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
