In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 15 | Yes |
Popular Name: (1S)-N-(1-ethylpropyl)-N-methyl-1-[(3S)-tetrahydrofuran-3-yl]ethane-1,2-diamine (1S)-N-(1-ethylpropyl)-N-methyl-…
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) | 1.37 | 1.94 | -43.08 | 3 | 3 | 1 | 40 | 215.361 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 3.77 | -120.08 | 4 | 3 | 2 | 41 | 216.369 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 3.26 | -29.54 | 3 | 3 | 1 | 40 | 215.361 | 6 | ↓ |