In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1S,2R)-N2-[(1S)-1,3-dimethylbutyl]-N1,N2-dimethyl-indane-1,2-diamine (1S,2R)-N2-[(1S)-1,3-dimethylbut…
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) | 3.67 | 8.61 | -34.41 | 2 | 2 | 1 | 16 | 261.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 10.2 | -106.88 | 3 | 2 | 2 | 21 | 262.441 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 8.64 | -30.71 | 2 | 2 | 1 | 20 | 261.433 | 5 | ↓ |