In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 16 | Yes |
Popular Name: (2R)-N-tert-butyl-2-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine (2R)-N-tert-butyl-2-methyl-3-(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) | 1.95 | 5.69 | -80.66 | 3 | 3 | 2 | 24 | 229.412 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 3.32 | -34.46 | 2 | 3 | 1 | 23 | 228.404 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 5.3 | -96.99 | 3 | 3 | 2 | 24 | 229.412 | 5 | ↓ |