In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 15 | Yes |
Popular Name: (3S,4S)-N3-[(1S)-2-methoxy-1-methyl-ethyl]-N3,N4-dimethyl-tetrahydropyran-3,4-diamine (3S,4S)-N3-[(1S)-2-methoxy-1-met…
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) | 0.53 | 1.63 | -36.44 | 2 | 4 | 1 | 38 | 217.333 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.53 | 0.81 | -1.69 | 1 | 4 | 0 | 34 | 216.325 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.53 | 1.86 | -30.13 | 2 | 4 | 1 | 35 | 217.333 | 5 | ↓ |