In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 20 | Yes |
Popular Name: N2,N2,N4,5,6-pentamethyl-N4-[(4-methylthiadiazol-5-yl)methyl]pyrimidine-2,4-diamine N2,N2,N4,5,6-pentamethyl-N4-[(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) | 2.47 | 9.12 | -34.48 | 1 | 6 | 1 | 59 | 293.42 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 8.85 | -12.26 | 0 | 6 | 0 | 58 | 292.412 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.