In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 18 | Yes |
Popular Name: N-[(2S)-2-(4-isobutylpiperazin-1-yl)butyl]cyclopropanamine N-[(2S)-2-(4-isobutylpiperazin-1…
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) | 2.37 | 7.42 | -89.56 | 3 | 3 | 2 | 24 | 255.45 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 5.46 | -32.96 | 2 | 3 | 1 | 23 | 254.442 | 7 | ↓ |