In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (1R,2S)-N'-cyclopropyl-N'-ethyl-1,2-diphenyl-ethane-1,2-diamine (1R,2S)-N'-cyclopropyl-N'-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) | 1.78 | 8.98 | -105.36 | 4 | 2 | 2 | 32 | 282.431 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.78 | 6.48 | -2.54 | 2 | 2 | 0 | 29 | 280.415 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.78 | 6.8 | -41.91 | 3 | 2 | 1 | 31 | 281.423 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 8.67 | -25.97 | 3 | 2 | 1 | 30 | 281.423 | 6 | ↓ |