In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 20 | Yes |
Popular Name: 1,1-dimethyl-3-[(1S)-3-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]urea 1,1-dimethyl-3-[(1S)-3-methyl-1-…
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) | 1.04 | 2.78 | -7.34 | 1 | 6 | 0 | 56 | 284.404 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 5.56 | -47.28 | 2 | 6 | 1 | 57 | 285.412 | 4 | ↓ |