In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2009 | 26 | Yes |
Popular Name: N-[(1R)-2-methyl-1-[4-(3-thienylmethyl)piperazine-1-carbonyl]propyl]thiophene-2-carboxamide N-[(1R)-2-methyl-1-[4-(3-thienyl…
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) | 2.37 | 6.03 | -8.47 | 1 | 5 | 0 | 53 | 391.562 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.37 | 8.77 | -49.09 | 2 | 5 | 1 | 54 | 392.57 | 6 | ↓ |