In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 14 | Yes |
Popular Name: N-isopropyl-N'-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]ethane-1,2-diamine N-isopropyl-N'-[2-[(2S)-tetrahyd…
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) | 0.48 | 3.99 | -110.88 | 4 | 3 | 2 | 42 | 202.342 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 2.8 | -36.74 | 3 | 3 | 1 | 38 | 201.334 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 2.63 | -34.02 | 3 | 3 | 1 | 38 | 201.334 | 7 | ↓ |