In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 36 | Yes |
Popular Name: 1-(4-benzhydrylpiperazin-1-yl)-4-(4-chlorophenyl)phthalazine 1-(4-benzhydrylpiperazin-1-yl)-4…
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) | 7.38 | 15.64 | -28.29 | 1 | 4 | 1 | 34 | 492.046 | 5 | ↓ |
Mid Mid (pH 6-8) | 7.38 | 17.43 | -101.42 | 2 | 4 | 2 | 35 | 493.054 | 5 | ↓ |
Mid Mid (pH 6-8) | 7.38 | 15.5 | -9.57 | 0 | 4 | 0 | 32 | 491.038 | 5 | ↓ |
Mid Mid (pH 6-8) | 7.38 | 17.3 | -40.84 | 1 | 4 | 1 | 33 | 492.046 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.