In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 35 | Yes |
Popular Name: N-[6-[4-[(2S)-3-benzyloxy-2-hydroxy-propyl]piperazin-1-yl]-3-pyridyl]-4-methoxy-benzamide N-[6-[4-[(2S)-3-benzyloxy-2-hydr…
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) | 3.08 | 6.79 | -14.99 | 2 | 8 | 0 | 87 | 476.577 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 7.11 | -40.63 | 3 | 8 | 1 | 88 | 477.585 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.08 | 9.04 | -49.97 | 3 | 8 | 1 | 88 | 477.585 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.08 | 9.36 | -108.24 | 4 | 8 | 2 | 90 | 478.593 | 10 | ↓ |