In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 32 | Yes |
Popular Name: (2S)-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-N-[(1S)-tetralin-1-yl]propanamide (2S)-2-[4-[(3,4-dimethoxyphenyl)…
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) | 2.18 | 9.41 | -44.71 | 2 | 6 | 1 | 55 | 438.592 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.18 | 7.26 | -13.7 | 1 | 6 | 0 | 54 | 437.584 | 7 | ↓ |