In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 21 | Yes |
Popular Name: 4-methyl-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]phthalazin-1-amine 4-methyl-N-[(4S)-4,5,6,7-tetrahy…
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) | 3.93 | 8.96 | -25.13 | 2 | 3 | 1 | 39 | 296.419 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.93 | 8.88 | -11.83 | 1 | 3 | 0 | 38 | 295.411 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.