| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 19 | Yes |
Popular Name: (3S,4S)-N3-[(2-fluorophenyl)methyl]-N3,N4-dimethyl-heptane-3,4-diamine (3S,4S)-N3-[(2-fluorophenyl)meth…
| 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) | 3.93 | 8.96 | -113 | 3 | 2 | 2 | 21 | 268.42 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.93 | 8.83 | -28.37 | 2 | 2 | 1 | 16 | 267.412 | 8 | ↓ |
