In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1R,2S)-N2-cyclopropyl-N1-ethyl-N2-(2-methoxyethyl)-1-phenyl-butane-1,2-diamine (1R,2S)-N2-cyclopropyl-N1-ethyl-…
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 | 8.45 | -98.86 | 3 | 3 | 2 | 30 | 292.467 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.30 | 6.84 | -33.7 | 2 | 3 | 1 | 29 | 291.459 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.30 | 7.03 | -29.22 | 2 | 3 | 1 | 26 | 291.459 | 10 | ↓ |