In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1R,2S)-N1-benzyl-N1-cyclopropyl-1-phenyl-propane-1,2-diamine (1R,2S)-N1-benzyl-N1-cyclopropyl…
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) | 2.90 | 9.04 | -111.42 | 4 | 2 | 2 | 32 | 282.431 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 8.73 | -30.5 | 3 | 2 | 1 | 30 | 281.423 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 7.42 | -40.5 | 3 | 2 | 1 | 31 | 281.423 | 6 | ↓ |