In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1S,2S)-N2-[(2-methoxyphenyl)methyl]-N2-methyl-N1-propyl-cyclopentane-1,2-diamine (1S,2S)-N2-[(2-methoxyphenyl)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) | 3.30 | 8.92 | -108.36 | 3 | 3 | 2 | 30 | 278.44 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 6.64 | -37.15 | 2 | 3 | 1 | 29 | 277.432 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.30 | 7.8 | -28.32 | 2 | 3 | 1 | 26 | 277.432 | 7 | ↓ |