In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 28 | Yes |
Popular Name: N-(4-chlorophenyl)-6-[(3S)-3-phenylpiperazin-1-yl]pyridine-3-carboxamide N-(4-chlorophenyl)-6-[(3S)-3-phe…
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) | 3.94 | 10.26 | -51.66 | 3 | 5 | 1 | 62 | 393.898 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.94 | 8.99 | -9.73 | 2 | 5 | 0 | 57 | 392.89 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.94 | 10.6 | -119.95 | 4 | 5 | 2 | 63 | 394.906 | 4 | ↓ |