In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 19 | Yes |
Popular Name: (4-cyclopropylpiperazin-1-yl)-(3,5-diaminophenyl)methanone (4-cyclopropylpiperazin-1-yl)-(3…
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) | -0.76 | 3.38 | -41.08 | 5 | 5 | 1 | 77 | 261.349 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.76 | 1.01 | -8.94 | 4 | 5 | 0 | 76 | 260.341 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.