In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 21 | Yes |
Popular Name: N-[[4-[(4-isopropylpiperazin-1-yl)methyl]thiazol-2-yl]methyl]-2-methyl-propan-2-amine N-[[4-[(4-isopropylpiperazin-1-y…
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) | 1.95 | 6.14 | -80.05 | 3 | 4 | 2 | 37 | 312.527 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 6 | -87.13 | 3 | 4 | 2 | 37 | 312.527 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.