In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 18 | Yes |
Popular Name: (4-amino-1-isopropyl-pyrrol-2-yl)-(4-methylpiperazin-1-yl)methanone (4-amino-1-isopropyl-pyrrol-2-yl…
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) | 0.64 | 2.62 | -7.74 | 2 | 5 | 0 | 55 | 250.346 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 4.98 | -42.87 | 3 | 5 | 1 | 56 | 251.354 | 2 | ↓ |