In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (1S,2S)-2-imidazol-1-yl-N-[(1R)-1-phenylbutyl]cyclopentanamine (1S,2S)-2-imidazol-1-yl-N-[(1R)-…
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) | 2.78 | 11.33 | -47.67 | 2 | 3 | 1 | 34 | 284.427 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.78 | 10.51 | -6.58 | 1 | 3 | 0 | 30 | 283.419 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 12.07 | -101.44 | 3 | 3 | 2 | 36 | 285.435 | 6 | ↓ |