In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2009 | 26 | Yes |
Popular Name: 1-[2-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]ethyl]-3-(p-tolyl)urea 1-[2-[(2S)-4-methyl-2-phenyl-pip…
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) | 3.40 | 8.22 | -47.81 | 3 | 5 | 1 | 49 | 353.49 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.40 | 5.76 | -12.35 | 2 | 5 | 0 | 48 | 352.482 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.40 | 10.14 | -128.09 | 4 | 5 | 2 | 50 | 354.498 | 5 | ↓ |