In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (2S)-N2-cyclopropyl-N2-ethyl-4-(4-methoxyphenyl)-2-methyl-butane-1,2-diamine (2S)-N2-cyclopropyl-N2-ethyl-4-(…
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) | 2.70 | 5.82 | -46.62 | 3 | 3 | 1 | 40 | 277.432 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 6.98 | -31.5 | 3 | 3 | 1 | 40 | 277.432 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 7.41 | -121.98 | 4 | 3 | 2 | 41 | 278.44 | 8 | ↓ |