In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1R,2R)-N1,N2-diethyl-N2-[[(2S)-tetrahydrofuran-2-yl]methyl]indane-1,2-diamine (1R,2R)-N1,N2-diethyl-N2-[[(2S)-…
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) | 2.82 | 6.76 | -36.58 | 2 | 3 | 1 | 29 | 289.443 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 5.63 | -3.73 | 1 | 3 | 0 | 24 | 288.435 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 7.84 | -32.49 | 2 | 3 | 1 | 26 | 289.443 | 6 | ↓ |