In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 18th, 2008 | 19 | Yes |
Popular Name: (2S)-N-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)propanamide (2S)-N-(4-fluorophenyl)-2-(4-met…
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) | 1.53 | 4.85 | -39.48 | 2 | 4 | 1 | 37 | 266.34 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.53 | 2.47 | -10.87 | 1 | 4 | 0 | 36 | 265.332 | 3 | ↓ |