In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 19 | Yes |
Popular Name: N3-[(5-iodo-2-furyl)methyl]-2-methoxy-N4,N4-dimethyl-pyridine-3,4-diamine N3-[(5-iodo-2-furyl)methyl]-2-me…
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) | 2.80 | 5.55 | -30.48 | 2 | 5 | 1 | 52 | 374.202 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 4.67 | -4.62 | 1 | 5 | 0 | 51 | 373.194 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.