In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 24 | Yes |
Popular Name: 1-[(1S)-3-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]-3-phenyl-urea 1-[(1S)-3-methyl-1-(4-methylpipe…
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) | 2.33 | 4.64 | -8.71 | 2 | 6 | 0 | 65 | 332.448 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 7.02 | -47.74 | 3 | 6 | 1 | 66 | 333.456 | 5 | ↓ |